Zhejiang Xianju Pharmaceutical Co Ltd | CAS 82543-16-6 | Related Intermediates | Manufacturers & Suppliers

CAS 82543-16-6

Chemistry, 3 End Use API, 6 Related Intermediates

Manufacturers/Suppliers

3 Suppliers

3 Suppliers

Also known as: 82543-16-6, 3b,5b-dihydroxy-6b,7b,15b,16b-dimethylene-5b-androst-17-one, 3beta,5-dihydroxy-6beta,7beta;15beta,16beta-dimethylene-5beta-androstan-17-one, (1r,2r,4r,5r,7s,10r,11s,14s,16s,18s,19s)-5,7-dihydroxy-10,14-dimethylhexacyclo[9.8.0.02,4.05,10.014,19.016,18]nonadecan-15-one, 6beta,7beta,15beta,16beta-dimethylene-3beta,5beta-dihydroxyandrostan-17-one, (2s,4ar,4bs,6as,7as,8as,8bs,8cr,8dr,9ar,9br)-2,9b-dihydroxy-4a,6a-dimethylhexadecahydro-1h-cyclopropa[4,5]cyclopenta[1,2-a]cyclopropa[l]phenanthren-7(7ah)-one

Molecular Formula

C₂₁H₃₀O₃

Molecular Weight

330.5 g/mol

InChI Key

GWUFXQIQXPASJU-VJWUOOCFSA-N

1 2D Structure

CAS 82543-16-6

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

(1R,2R,4R,5R,7S,10R,11S,14S,16S,18S,19S)-5,7-dihydroxy-10,14-dimethylhexacyclo[9.8.0.02,4.05,10.014,19.016,18]nonadecan-15-one

2.1.2 InChI

InChI=1S/C21H30O3/c1-19-5-4-14-16(17(19)11-7-12(11)18(19)23)13-8-15(13)21(24)9-10(22)3-6-20(14,21)2/h10-17,22,24H,3-9H2,1-2H3/t10-,11+,12-,13-,14-,15+,16+,17-,19-,20+,21+/m0/s1

2.1.3 InChI Key

GWUFXQIQXPASJU-VJWUOOCFSA-N

2.1.4 Canonical SMILES

CC12CCC(CC1(C3CC3C4C2CCC5(C4C6CC6C5=O)C)O)O

2.1.5 Isomeric SMILES

C[C@]12CC[C@@H](C[C@]1([C@@H]3C[C@@H]3[C@@H]4[C@@H]2CC[C@]5([C@H]4[C@@H]6C[C@@H]6C5=O)C)O)O

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 82543-16-6

2. 3b,5b-dihydroxy-6b,7b,15b,16b-dimethylene-5b-androst-17-one

3. 3beta,5-dihydroxy-6beta,7beta;15beta,16beta-dimethylene-5beta-androstan-17-one

4. (1r,2r,4r,5r,7s,10r,11s,14s,16s,18s,19s)-5,7-dihydroxy-10,14-dimethylhexacyclo[9.8.0.02,4.05,10.014,19.016,18]nonadecan-15-one

5. 6beta,7beta,15beta,16beta-dimethylene-3beta,5beta-dihydroxyandrostan-17-one

6. (2s,4ar,4bs,6as,7as,8as,8bs,8cr,8dr,9ar,9br)-2,9b-dihydroxy-4a,6a-dimethylhexadecahydro-1h-cyclopropa[4,5]cyclopenta[1,2-a]cyclopropa[l]phenanthren-7(7ah)-one

7. Ec 617-347-4

8. Schembl13936420

9. Mfcd09952196

10. Zinc72399748

11. Akos025311213

12. (3s,5r,6r,7r,8r,9s,10r,13s,14s,15s, 16s)-octadecahydro-3,5-dihydroxy-10,13-dimethyl-17h-dicyclopropa(6,7:15,16)cyclopenta(a)phenanthren-17-one

13. Ac-28721

14. As-13047

15. C76643

16. 543d166

17. Q-102812

18. 3?,5?-dihydroxy-6?,7?;15?,16?-dimethylene-androst-17-one

19. 6?,7?,15?,16?-dimethylene-3?,5?-dihydroxyandrostan-17-one

20. 7b-hydroxy-15b,16b-methylene-3b-pivaloyloxy-5 Androsten-17-one

21. 6

22. A,7

23. A,15

24. A,16

25. A-dimethylene-3

26. A,5

27. A-dihydroxyandrostan-17-one

28. 3beta,5-dihydroxy-6beta,7beta:15beta,16beta-dimethylene-5beta-androstane-17-one

29. 3beta,5-dihydroxy-6beta,7beta15beta,16beta-dimethylene-5beta-androstan-17-one

30. (2s,4ar,4bs,6as,7as,9as,9br,9cr,11as)-2,11a-dihydroxy-4a,6a-dimethyloctadecahydro-7h-cyclobuta[4,5]cyclopenta[1,2-a]phenanthren-7-on E

2.3 Create Date

2007-02-08

3 Chemical and Physical Properties

Molecular Formula	C₂₁H₃₀O₃
Molecular Weight	330.5 g/mol
XLogP3	2.4
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	330.21949481 g/mol
Monoisotopic Mass	330.21949481 g/mol
Topological Polar Surface Area	57.5 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	645
Isotope Atom Count	0
Defined Atom Stereocenter Count	11
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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CAS Number

82543-16-6

End Use API

Drospirenone

About the Company

With the high technology and excellent services, Xianju pharma earned a top worldwide reputation for qual...

With the high technology and excellent services, Xianju pharma earned a top worldwide reputation for quality in pharmaceutical industry. Xianju pharma has dedicated to scientific research since we were established in 1972.We developed over 100 Active Pharmaceutical Ingredients and finished formulations from then on , becoming a leader of steroids and hormones manufacturing in China. Xianju pharma has full of confidence to be a global supplier of active pharmaceutical ingredients with customized solid state specifications and unparalleled intellectual property that accomplishment our cooperation.

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