Chola-7,20(22)-dien-21-oic acid, 23,23,24-trihydroxy-4,4,14-trimethyl-3-oxo-, γ-lactone, (5α,13α,14β,17α)-

CAS Registry Number®

1337973-01-9

CAS Name

Chola-7,20(22)-dien-21-oic acid, 23,23,24-trihydroxy-4,4,14-trimethyl-3-oxo-, γ-lactone, (5α,13α,14β,17α)-

Molecular Formula

C27H38O5

Molecular Mass

442.59

Cite this Page

Chola-7,20(22)-dien-21-oic acid, 23,23,24-trihydroxy-4,4,14-trimethyl-3-oxo-, γ-lactone, (5α,13α,14β,17α)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1337973-01-9 (retrieved 2024-11-08) (CAS RN: 1337973-01-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C27H38O5/c1-23(2)20-7-6-19-18(24(20,3)11-10-21(23)29)9-13-25(4)17(8-12-26(19,25)5)16-14-27(31,15-28)32-22(16)30/h6,14,17-18,20,28,31H,7-13,15H2,1-5H3/t17-,18-,20-,24+,25-,26+,27?/m0/s1

InChIKey

InChIKey=DKUCZRZGAXYSEA-LRJKLRJMSA-N

SMILES

C[C@@]12C=3[C@@]([C@]4(C)[C@@](CC3)(C(C)(C)C(=O)CC4)[H])(CC[C@@]1(C)[C@@H](CC2)C5=CC(CO)(O)OC5=O)[H]

Canonical SMILES

O=C1OC(O)(C=C1C2CCC3(C4=CCC5C(C(=O)CCC5(C)C4CCC23C)(C)C)C)CO

Other Names for this Substance

  • Chola-7,20(22)-dien-21-oic acid, 23,23,24-trihydroxy-4,4,14-trimethyl-3-oxo-, γ-lactone, (5α,13α,14β,17α)-
  • Dysolenticin C

CAS INSIGHTSTM
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