(3β,25R)-3-Hydroxy-24-methylene-9,19-cyclolanostan-26-oic acid

CAS Registry Number®

13878-93-8

CAS Name

(3β,25R)-3-Hydroxy-24-methylene-9,19-cyclolanostan-26-oic acid

Molecular Formula

C31H50O3

Molecular Mass

470.73

Cite this Page

(3β,25R)-3-Hydroxy-24-methylene-9,19-cyclolanostan-26-oic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=13878-93-8 (retrieved 2024-11-22) (CAS RN: 13878-93-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    168-170 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C31H50O3/c1-19(21(3)26(33)34)8-9-20(2)22-12-14-29(7)24-11-10-23-27(4,5)25(32)13-15-30(23)18-31(24,30)17-16-28(22,29)6/h20-25,32H,1,8-18H2,2-7H3,(H,33,34)/t20-,21?,22-,23+,24+,25+,28-,29+,30-,31+/m1/s1

InChIKey

InChIKey=FCQSIIVNJCMJLB-KAETVPQKSA-N

SMILES

C[C@]12[C@]3([C@]4([C@]5(C4)[C@](C(C)(C)[C@@H](O)CC5)(CC3)[H])CC[C@]1(C)[C@@]([C@@H](CCC(C(C(O)=O)C)=C)C)(CC2)[H])[H]

Canonical SMILES

O=C(O)C(C(=C)CCC(C)C1CCC2(C)C3CCC4C(C)(C)C(O)CCC54CC35CCC12C)C

Other Names for this Substance

  • 9,19-Cyclolanostan-26-oic acid, 3-hydroxy-24-methylene-, (3β,25R)-
  • 9,19-Cyclo-9β-lanostan-26-oic acid, 3β-hydroxy-24-methylene-
  • (3β,25R)-3-Hydroxy-24-methylene-9,19-cyclolanostan-26-oic acid
  • Ambolic acid

CAS INSIGHTSTM
Targeted protein degrader structure, illustration