Olean-12-en-28-oic acid, 16-hydroxy-3-oxo-, (16β)-

CAS Registry Number®

77625-71-9

CAS Name

Olean-12-en-28-oic acid, 16-hydroxy-3-oxo-, (16β)-

Molecular Formula

C30H46O4

Molecular Mass

470.68

Cite this Page

Olean-12-en-28-oic acid, 16-hydroxy-3-oxo-, (16β)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=77625-71-9 (retrieved 2025-01-07) (CAS RN: 77625-71-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C30H46O4/c1-25(2)14-15-30(24(33)34)19(16-25)18-8-9-21-27(5)12-11-22(31)26(3,4)20(27)10-13-28(21,6)29(18,7)17-23(30)32/h8,19-21,23,32H,9-17H2,1-7H3,(H,33,34)/t19-,20-,21+,23-,27-,28+,29+,30+/m0/s1

InChIKey

InChIKey=NMCMUIZIKSPDCX-WAEMMRLPSA-N

SMILES

C(O)(=O)[C@]12[C@](C=3[C@@](C)(C[C@@H]1O)[C@@]4(C)[C@](CC3)([C@]5(C)[C@@](CC4)(C(C)(C)C(=O)CC5)[H])[H])(CC(C)(C)CC2)[H]

Canonical SMILES

O=C(O)C12CCC(C)(C)CC2C3=CCC4C5(C)CCC(=O)C(C)(C)C5CCC4(C)C3(C)CC1O

Other Names for this Substance

  • Olean-12-en-28-oic acid, 16-hydroxy-3-oxo-, (16β)-
  • 16β-Hydroxy-3-oxoolean-12-en-28-oic acid

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