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Chemistry

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Also known as: Cotadutide [inn], Cotadutide [usan], Medi0382, Medi-0382, Ql6a9b13hw, Medi 0382 [who-dd]
Molecular Formula
C167H252N42O55
Molecular Weight
3728.0  g/mol
InChI Key
YEKUUBPJRPXMBM-PTCFZACGSA-N
FDA UNII
QL6A9B13HW

Cotadutide
Cotadutide is under investigation in clinical trial NCT03444584 (Study of MEDI0382 in Combination With Dapagliflozin and Metformin in Overweight/Obese Subject With Type 2 Diabetes).
1 2D Structure

Cotadutide

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(2S)-5-[[(5S)-5-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S,3R)-2-[[2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-amino-3-(1H-imidazol-4-yl)propanoyl]amino]-3-hydroxypropanoyl]amino]-5-oxopentanoyl]amino]acetyl]amino]-3-hydroxybutanoyl]amino]-3-phenylpropanoyl]amino]-3-hydroxybutanoyl]amino]-3-hydroxypropanoyl]amino]-3-carboxypropanoyl]amino]-6-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-5-carbamimidamido-1-[[(2S)-1-[[(2S)-5-carbamimidamido-1-[[(2S)-3-carboxy-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-4-carboxy-1-[[(2S)-1-[[2-(carboxymethylamino)-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-1-oxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopentan-2-yl]amino]-4-carboxy-1-oxobutan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-4-carboxy-1-oxobutan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-6-oxohexyl]amino]-2-(hexadecanoylamino)-5-oxopentanoic acid
2.1.2 InChI
InChI=1S/C167H252N42O55/c1-13-14-15-16-17-18-19-20-21-22-23-24-31-47-125(219)186-109(165(263)264)53-58-124(218)175-62-35-34-44-102(189-153(251)116(72-131(228)229)201-161(259)122(83-213)206-164(262)137(92(12)215)209-157(255)114(68-94-40-29-26-30-41-94)202-163(261)136(91(11)214)207-127(221)78-181-142(240)105(52-57-123(169)217)190-158(256)119(80-210)203-141(239)100(168)71-97-76-174-84-182-97)146(244)204-120(81-211)159(257)193-108(56-61-130(226)227)148(246)197-112(69-95-48-50-98(216)51-49-95)151(249)195-111(66-86(4)5)150(248)200-118(74-133(232)233)155(253)205-121(82-212)160(258)192-107(55-60-129(224)225)147(245)188-103(45-36-63-176-166(170)171)143(241)184-89(9)139(237)187-104(46-37-64-177-167(172)173)145(243)199-117(73-132(230)231)154(252)198-113(67-93-38-27-25-28-39-93)156(254)208-135(87(6)7)162(260)185-90(10)140(238)194-115(70-96-75-178-101-43-33-32-42-99(96)101)152(250)196-110(65-85(2)3)149(247)191-106(54-59-128(222)223)144(242)183-88(8)138(236)180-77-126(220)179-79-134(234)235/h25-30,32-33,38-43,48-51,75-76,84-92,100,102-122,135-137,178,210-216H,13-24,31,34-37,44-47,52-74,77-83,168H2,1-12H3,(H2,169,217)(H,174,182)(H,175,218)(H,179,220)(H,180,236)(H,181,240)(H,183,242)(H,184,241)(H,185,260)(H,186,219)(H,187,237)(H,188,245)(H,189,251)(H,190,256)(H,191,247)(H,192,258)(H,193,257)(H,194,238)(H,195,249)(H,196,250)(H,197,246)(H,198,252)(H,199,243)(H,200,248)(H,201,259)(H,202,261)(H,203,239)(H,204,244)(H,205,253)(H,206,262)(H,207,221)(H,208,254)(H,209,255)(H,222,223)(H,224,225)(H,226,227)(H,228,229)(H,230,231)(H,232,233)(H,234,235)(H,263,264)(H4,170,171,176)(H4,172,173,177)/t88-,89-,90-,91+,92+,100-,102-,103-,104-,105-,106-,107-,108-,109-,110-,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,135-,136-,137-/m0/s1
2.1.3 InChI Key
YEKUUBPJRPXMBM-PTCFZACGSA-N
2.1.4 Canonical SMILES
CCCCCCCCCCCCCCCC(=O)NC(CCC(=O)NCCCCC(C(=O)NC(CO)C(=O)NC(CCC(=O)O)C(=O)NC(CC1=CC=C(C=C1)O)C(=O)NC(CC(C)C)C(=O)NC(CC(=O)O)C(=O)NC(CO)C(=O)NC(CCC(=O)O)C(=O)NC(CCCNC(=N)N)C(=O)NC(C)C(=O)NC(CCCNC(=N)N)C(=O)NC(CC(=O)O)C(=O)NC(CC2=CC=CC=C2)C(=O)NC(C(C)C)C(=O)NC(C)C(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)NC(CC(C)C)C(=O)NC(CCC(=O)O)C(=O)NC(C)C(=O)NCC(=O)NCC(=O)O)NC(=O)C(CC(=O)O)NC(=O)C(CO)NC(=O)C(C(C)O)NC(=O)C(CC5=CC=CC=C5)NC(=O)C(C(C)O)NC(=O)CNC(=O)C(CCC(=O)N)NC(=O)C(CO)NC(=O)C(CC6=CNC=N6)N)C(=O)O
2.1.5 Isomeric SMILES
CCCCCCCCCCCCCCCC(=O)N[C@@H](CCC(=O)NCCCC[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC3=CNC4=CC=CC=C43)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CC5=CC=CC=C5)NC(=O)[C@H]([C@@H](C)O)NC(=O)CNC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC6=CNC=N6)N)C(=O)O
2.2 Other Identifiers
2.2.1 UNII
QL6A9B13HW
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Medi0382

2.3.2 Depositor-Supplied Synonyms

1. Cotadutide [inn]

2. Cotadutide [usan]

3. Medi0382

4. Medi-0382

5. Ql6a9b13hw

6. Medi 0382 [who-dd]

7. 1686108-82-6

8. Cotadutide [usan:inn]

9. Medi 0382

10. Unii-ql6a9b13hw

11. Chembl4297630

12. Dtxsid601336753

13. Db15194

14. Glycine, L-histidyl-l-seryl-l-glutaminylglycyl-l-threonyl-l-phenylalanyl-l-threonyl-l-seryl-l-alpha-aspartyl-n6-(n-(1-oxotetradecyl)-l-gamma-glutamyl)-l-lysyl-l-seryl-l-alpha-glutamyl-l-tyrosyl-l-leucyl-l-alpha-aspartyl-l-seryl-l-alpha-glutamyl

15. His-ser-gln-gly-thr-phe-thr-ser-asp-lys-(.gamma.-glupalmitoyl)-ser-glu-tyr-leu-asp-ser-glu-arg-ala-arg-asp- Phe-val-ala-trp-leu-glu-ala-gly-gly

16. His-ser-gln-gly-thr-phe-thr-ser-asp-lys-(gamma-glupalmitoyl)-ser-glu-tyr-leu-asp-ser-glu-arg-ala-arg-asp- Phe-val-ala-trp-leu-glu-ala-gly-gly

2.4 Create Date
2018-08-16
3 Chemical and Physical Properties
Molecular Weight 3728.0 g/mol
Molecular Formula C167H252N42O55
XLogP3-7.9
Hydrogen Bond Donor Count56
Hydrogen Bond Acceptor Count59
Rotatable Bond Count132
Exact Mass3726.8246751 g/mol
Monoisotopic Mass3725.8213203 g/mol
Topological Polar Surface Area1580 Ų
Heavy Atom Count264
Formal Charge0
Complexity8760
Isotope Atom Count0
Defined Atom Stereocenter Count30
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Drug and Medication Information
4.1 Drug Indication

Treatment of non-alcoholic steatohepatitis (NASH)


Treatment of type II diabetes mellitus


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Looking for 1686108-82-6 / Cotadutide API manufacturers, exporters & distributors?

Cotadutide manufacturers, exporters & distributors 1

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PharmaCompass offers a list of Cotadutide API manufacturers, exporters & distributors, which can be sorted by GMP, USDMF, JDMF, KDMF, CEP (COS), WC, Price,and more, enabling you to easily find the right Cotadutide manufacturer or Cotadutide supplier for your needs.

Send us enquiries for free, and we will assist you in establishing a direct connection with your preferred Cotadutide manufacturer or Cotadutide supplier.

PharmaCompass also assists you with knowing the Cotadutide API Price utilized in the formulation of products. Cotadutide API Price is not always fixed or binding as the Cotadutide Price is obtained through a variety of data sources. The Cotadutide Price can also vary due to multiple factors, including market conditions, regulatory modifications, or negotiated pricing deals.

API | Excipient name

Cotadutide

Synonyms

Cotadutide [inn], Cotadutide [usan], Medi0382, Medi-0382, Ql6a9b13hw, Medi 0382 [who-dd]

Cas Number

1686108-82-6

Unique Ingredient Identifier (UNII)

QL6A9B13HW

About Cotadutide

Cotadutide is under investigation in clinical trial NCT03444584 (Study of MEDI0382 in Combination With Dapagliflozin and Metformin in Overweight/Obese Subject With Type 2 Diabetes).

Cotadutide Manufacturers

A Cotadutide manufacturer is defined as any person or entity involved in the manufacture, preparation, processing, compounding or propagation of Cotadutide, including repackagers and relabelers. The FDA regulates Cotadutide manufacturers to ensure that their products comply with relevant laws and regulations and are safe and effective to use. Cotadutide API Manufacturers are required to adhere to Good Manufacturing Practices (GMP) to ensure that their products are consistently manufactured to meet established quality criteria.

Cotadutide Suppliers

A Cotadutide supplier is an individual or a company that provides Cotadutide active pharmaceutical ingredient (API) or Cotadutide finished formulations upon request. The Cotadutide suppliers may include Cotadutide API manufacturers, exporters, distributors and traders.

Cotadutide GMP

Cotadutide Active pharmaceutical ingredient (API) is produced in GMP-certified manufacturing facility.

GMP stands for Good Manufacturing Practices, which is a system used in the pharmaceutical industry to make sure that goods are regularly produced and monitored in accordance with quality standards. The FDA’s current Good Manufacturing Practices requirements are referred to as cGMP or current GMP which indicates that the company follows the most recent GMP specifications. The World Health Organization (WHO) has its own set of GMP guidelines, called the WHO GMP. Different countries can also set their own guidelines for GMP like China (Chinese GMP) or the EU (EU GMP).

PharmaCompass offers a list of Cotadutide GMP manufacturers, exporters & distributors, which can be sorted by USDMF, JDMF, KDMF, CEP (COS), WC, API price, and more, enabling you to easily find the right Cotadutide GMP manufacturer or Cotadutide GMP API supplier for your needs.

Cotadutide CoA

A Cotadutide CoA (Certificate of Analysis) is a formal document that attests to Cotadutide's compliance with Cotadutide specifications and serves as a tool for batch-level quality control.

Cotadutide CoA mostly includes findings from lab analyses of a specific batch. For each Cotadutide CoA document that a company creates, the USFDA specifies specific requirements, such as supplier information, material identification, transportation data, evidence of conformity and signature data.

Cotadutide may be tested according to a variety of international standards, such as European Pharmacopoeia (Cotadutide EP), Cotadutide JP (Japanese Pharmacopeia) and the US Pharmacopoeia (Cotadutide USP).

Inform the supplier about your product requirements, specifying if you need a product with particular monograph like EP (Ph. Eur.), USP, JP, BP, or any other quality. In addition, clarify whether you need hydrochloride (HCl), anhydricum, base, micronisatum or a specific level of purity. To find reputable suppliers, utilize the filters and select those certified by GMP, FDA, or any other certification as per your requirement.
For your convenience, we have listed synonyms and CAS numbers to help you find the best supplier. The use of synonyms and CAS numbers can be helpful in identifying potential suppliers, but it is crucial to note that they might not always indicate the exact same product. It is important to confirm the product details with the supplier before making a purchase to ensure that it meets your requirements.
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