Dalbavancin Hydrochloride

Synopsis, Chemistry

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19 API Suppliers, 5 USDMF, 3 NDC API, 14 Listed Suppliers

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2 Drug(s) in Development

2 Drug(s) in Development

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API Reference Price, API Exports, API Imports

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1 Suppliers

1 Suppliers

DOSSIERs // Finished Dosage Formulations

3 Dossiers, 1 FDA Orange Book, 2 Europe

RELATED EXCIPIENT COMPANIES

Suppliers, 16 Kerry, 12 SPI Pharma, 6 Gangwal Healthcare, 4 Microlex e.U, 3 Sigachi Industries, 3 Roquette, 2 DFE Pharma, 2 Gangwal Chemicals, 1 Shijiazhuang Huaxu Pharmaceutical, 1 Shanghai Shenmei Pharmaceutical Technology Co., Ltd, 1 Rochem International Inc, 1 Nanjing Well Pharmaceutical, 1 Ingredion Pharma Solutions, 1 Pfanstiehl, 1 DKSH, 1 BASF

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36 Fillers, Diluents & Binders, 17 Direct Compression, 10 Chewable & Orodispersible Aids, 9 Taste Masking, 8 Co-Processed Excipients, 7 Granulation, 4 Parenteral, 4 Disintegrants & Superdisintegrants, 1 API Stability Enhancers, 1 Thickeners and Stabilizers

GLOBAL SALES INFORMATION

7 US Medicaid Prescriptions, 1 Finished Drug Prices

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5 APIs

5 APIs

PATENTS

1 US Patents, 3 US Exclusivities

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1 Other Ref. Standards

1 Other Ref. Standards

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3 Data Compilations & Company Tracker #PharmaFlow, 11 News

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Also known as: Dalbavancin (hydrochloride), Ver 001, Ver-001, Dalbavancin hcl, Chembl3301650, Dalbavancin hydrochloride (5:8)

Molecular Formula

C₈₈H₁₀₁Cl₃N₁₀O₂₈

Molecular Weight

1853.1 g/mol

InChI Key

PEXPCJWLNBNBNT-AXKGEONOSA-N

1 2D Structure

Dalbavancin Hydrochloride

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

(2S,3S,4R,5R,6S)-6-[[(1S,2R,19R,22R,34S,37R,40R,52S)-5,32-dichloro-52-[3-(dimethylamino)propylcarbamoyl]-2,26,31,44,49-pentahydroxy-22-(methylamino)-21,35,38,54,56,59-hexaoxo-47-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-7,13,28-trioxa-20,36,39,53,55,58-hexazaundecacyclo[38.14.2.23,6.214,17.219,34.18,12.123,27.129,33.141,45.010,37.046,51]hexahexaconta-3,5,8,10,12(64),14(63),15,17(62),23(61),24,26,29(60),30,32,41(57),42,44,46(51),47,49,65-henicosaen-64-yl]oxy]-3,4-dihydroxy-5-(10-methylundecanoylamino)oxane-2-carboxylic acid;hydrochloride

2.1.2 InChI

InChI=1S/C88H100Cl2N10O28.ClH/c1-38(2)13-10-8-6-7-9-11-14-61(106)94-70-73(109)75(111)78(86(120)121)128-87(70)127-77-58-31-43-32-59(77)124-55-24-19-42(29-50(55)89)71(107)69-85(119)98-67(80(114)92-25-12-26-100(4)5)48-33-44(102)34-57(125-88-76(112)74(110)72(108)60(37-101)126-88)62(48)47-28-40(17-22-52(47)103)65(82(116)99-69)95-83(117)66(43)96-84(118)68-49-35-46(36-54(105)63(49)90)123-56-30-41(18-23-53(56)104)64(91-3)81(115)93-51(79(113)97-68)27-39-15-20-45(122-58)21-16-39;/h15-24,28-36,38,51,60,64-76,78,87-88,91,101-105,107-112H,6-14,25-27,37H2,1-5H3,(H,92,114)(H,93,115)(H,94,106)(H,95,117)(H,96,118)(H,97,113)(H,98,119)(H,99,116)(H,120,121);1H/t51-,60-,64-,65-,66-,67+,68+,69+,70-,71-,72-,73-,74+,75+,76+,78+,87-,88+;/m1./s1

2.1.3 InChI Key

PEXPCJWLNBNBNT-AXKGEONOSA-N

2.1.4 Canonical SMILES

CC(C)CCCCCCCCC(=O)NC1C(C(C(OC1OC2=C3C=C4C=C2OC5=C(C=C(C=C5)C(C6C(=O)NC(C7=C(C(=CC(=C7)O)OC8C(C(C(C(O8)CO)O)O)O)C9=C(C=CC(=C9)C(C(=O)N6)NC(=O)C4NC(=O)C1C2=C(C(=CC(=C2)OC2=C(C=CC(=C2)C(C(=O)NC(CC2=CC=C(O3)C=C2)C(=O)N1)NC)O)O)Cl)O)C(=O)NCCCN(C)C)O)Cl)C(=O)O)O)O.Cl

2.1.5 Isomeric SMILES

CC(C)CCCCCCCCC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1OC2=C3C=C4C=C2OC5=C(C=C(C=C5)[C@H]([C@H]6C(=O)N[C@@H](C7=C(C(=CC(=C7)O)O[C@@H]8[C@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)C9=C(C=CC(=C9)[C@H](C(=O)N6)NC(=O)[C@@H]4NC(=O)[C@@H]1C2=C(C(=CC(=C2)OC2=C(C=CC(=C2)[C@H](C(=O)N[C@H](CC2=CC=C(O3)C=C2)C(=O)N1)NC)O)O)Cl)O)C(=O)NCCCN(C)C)O)Cl)C(=O)O)O)O.Cl

2.2 Synonyms

2.2.1 MeSH Synonyms

1. A-a-1 Antibiotic

2. Bi 397

3. Bi-397

4. Bi397

5. Dalbavancin

6. Dalvance

7. Mdl 64,397

8. Mdl-64397

9. Ver-001

10. Ver001

11. Xydalba

12. Zeven

2.2.2 Depositor-Supplied Synonyms

1. Dalbavancin (hydrochloride)

2. Ver 001

3. Ver-001

4. Dalbavancin Hcl

5. Chembl3301650

6. Dalbavancin Hydrochloride (5:8)

7. A-a 1

8. Cs-3579

9. Hy-17586

2.3 Create Date

2014-12-31

3 Chemical and Physical Properties

Molecular Formula	C₈₈H₁₀₁Cl₃N₁₀O₂₈
Molecular Weight	1853.1 g/mol
Hydrogen Bond Donor Count	22
Hydrogen Bond Acceptor Count	30
Rotatable Bond Count	22
Exact Mass	1850.585236 g/mol
Monoisotopic Mass	1850.585236 g/mol
Topological Polar Surface Area	573 Å²
Heavy Atom Count	129
Formal Charge	0
Complexity	3740
Isotope Atom Count	0
Defined Atom Stereocenter Count	18
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2

4 Drug and Medication Information

4.1 Drug Indication

Treatment of acute bacterial skin and skin structure infections (ABSSSI) in adults.

5 Pharmacology and Biochemistry

5.1 MeSH Pharmacological Classification

Anti-Bacterial Agents

Substances that inhibit the growth or reproduction of BACTERIA. (See all compounds classified as Anti-Bacterial Agents.)

5.2 ATC Code

J01XA04

Find Dalbavancin manufacturers, exporters & distributors on PharmaCompass

Dalbavancin Hydrochloride

Dalbavancin Hydrochloride

Synopsis

Chemistry

APIs // Active Pharmaceutical Ingredients

19 API Suppliers

5 USDMF

3 NDC API

14 Listed Suppliers

DEVELOPMENTS

2 Drug(s) in Development

PRICE INFORMATION

API Reference Price

API Exports

API Imports

INTERMEDIATES

1 Suppliers

DOSSIERs // Finished Dosage Formulations

3 Dossiers

1 FDA Orange Book

2 Europe

RELATED EXCIPIENT COMPANIES

Suppliers

16 Kerry

12 SPI Pharma

6 Gangwal Healthcare

4 Microlex e.U

3 Sigachi Industries

3 Roquette

2 DFE Pharma

2 Gangwal Chemicals

1 Shijiazhuang Huaxu Pharmaceutical

1 Shanghai Shenmei Pharmaceutical Technology Co., Ltd

1 Rochem International Inc

1 Nanjing Well Pharmaceutical

1 Ingredion Pharma Solutions

1 Pfanstiehl

1 DKSH

1 BASF

EXCIPIENTS BY APPLICATIONS

36 Fillers, Diluents & Binders

17 Direct Compression

10 Chewable & Orodispersible Aids

9 Taste Masking

8 Co-Processed Excipients

7 Granulation

4 Parenteral

4 Disintegrants & Superdisintegrants

1 API Stability Enhancers

1 Thickeners and Stabilizers

GLOBAL SALES INFORMATION

7 US Medicaid Prescriptions

1 Finished Drug Prices

MARKET PLACE

5 APIs

PATENTS

1 US Patents

3 US Exclusivities

ANALYTICAL SOLUTION(s)

1 Other Ref. Standards

DIGITAL CONTENT

3 Data Compilations & Company Tracker #PharmaFlow

11 News

API SUPPLIERS

API REF. PRICE (USD / KG)

INTERMEDIATES

DOSSIERS // FDF

GLOBAL SALES (USD Million)

EXCIPIENTS

PATENTS & EXCLUSIVITIES

DIGITAL CONTENT

REF STANDARD

SERVICES

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