Primary Record
CHEMBL2087166
- In stock
- 2,135 g
- Purity
- 98.2 %
- CAS
- 19404-87-6
Compound Identifiers & Properties
- CAS
- 19404-87-6
- PubChem CID
- 10974080
- SMILES
- CC(=O)O[C@@H]1C[C@H]2C(=O)C=C3[C@@H]([C@]2(C[C@@H]1OC(=O)C)C)CC[C@]4([C@]3(CC[C@@H]4[C@](C)([C@@H](CCC(C)(C)O)OC(=O)C)O)O)C
- Canonical SMILES
- CC(=O)O[C@H]1C[C@@]2(C)[C@@H](C[C@H]1OC(C)=O)C(=O)C=C1[C@@H]2CC[C@]2(C)[C@@H]([C@@](C)(O)[C@@H](CCC(C)(C)O)OC(C)=O)CC[C@@]12O
Names & Synonyms
- CHEMBL2087166
- MJKOCZIZHOHSNY-OWFCURGQSA-
- DTXSID701339950
- CID10974080
- CID 10974080
- J921.021K
- (22R)-2beta,3beta,22-Triacetoxy-14,20,25-trihydroxy-5beta-cholest-7-en-6-one
- (22R)-6-Oxo-5beta-cholesta-7-ene-2beta,3beta,14alpha,20,22,25-hexaol 2,3,22-triacetate
- (2beta, 3beta, 5beta, 22R)-2,3,22-Tris(acetyloxy)-14,20,25-trihydroxycholest-7-en-6-one
- (2R,3R)-2-[(1S,3aS,5aR,7R,8S,9aR,9bR,11aR)-7,8-bis(acetyloxy)-3a-hydroxy-9a,11a-dimethyl-5-oxo-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]-2,6-dihydroxy-6-methylheptan-3-yl acetate
- 19404-87-6
- InChI=1/C33H50O10/c1-18(34)41-25-16-23-24(37)15-22-21(30(23,6)17-26(25)42-19(2)35)9-13-31(7)27(10-14-33(22,31)40)32(8,39)28(43-20(3)36)11-12-29(4,5)38/h15,21,23,25-28,38-40H,9-14,16-17H2,1-8H3/t21-,23-,25+,26-,27-,28+,30+,31+,32+,33+/m0/s1