$350.00
| CAS No.: | 942936-54-1 |
| Molecular Formula | C₂₇H₄₀O₆ |
| Molecular Weight | 460.6g/mol |
| Purity | HPLC>98% |
| Chemical Family | Steroids |
| Weight |
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IUPAC Name: (4S)-4-[(5S,10R,13S,14S,17S)-7,15-dihydroxy-4,4,10,13,14-pentamethyl-3,11-dioxo-2,5,6,7,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
InChI: InChI=1S/C27H40O6/c1-14(7-8-21(32)33)15-11-20(31)27(6)23-16(28)12-18-24(2,3)19(30)9-10-25(18,4)22(23)17(29)13-26(15,27)5/h14-16,18,20,28,31H,7-13H2,1-6H3,(H,32,33)/t14-,15-,16?,18+,20?,25+,26-,27+/m0/s1
InChIKey: JBKAGLHPUJBTTD-OGMYJHHNSA-N
Canonical SMILES: CC(CCC(=O)O)C1CC(C2(C1(CC(=O)C3=C2C(CC4C3(CCC(=O)C4(C)C)C)O)C)C)O
Isomeric SMILES: C[C@@H](CCC(=O)O)[C@@H]1CC([C@]2([C@]1(CC(=O)C3=C2C(C[C@H]4[C@]3(CCC(=O)C4(C)C)C)O)C)C)O
Synonyms: 942936-54-1; (4S)-4-[(5S,10R,13S,14S,17S)-7,15-Dihydroxy-4,4,10,13,14-pentamethyl-3,11-dioxo-2,5,6,7,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid; 7,15-dihydroxy-4,4,14-trimethyl-3,11-dioxochol-8-en-24-oic acid; E88838; (4S)-4-[(1S,3aS,5aS,9aR,11aS)-3,4-dihydroxy-3a,6,6,9a,11a-pentamethyl-7,10-dioxo-1H,2H,3H,4H,5H,5aH,8H,9H,11H-cyclopenta[a]phenanthren-1-yl]pentanoic acid
Botanical Source:
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