(3β)-3,17-Dihydroxy-28-norolean-12-en-16-one

CAS Registry Number®

81426-91-7
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CAS Name

(3β)-3,17-Dihydroxy-28-norolean-12-en-16-one

Molecular Formula

C29H46O3

Molecular Mass

442.67

Cite this Page

(3β)-3,17-Dihydroxy-28-norolean-12-en-16-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=81426-91-7 (retrieved 2024-09-19) (CAS RN: 81426-91-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C29H46O3/c1-24(2)14-15-29(32)19(16-24)18-8-9-21-26(5)12-11-22(30)25(3,4)20(26)10-13-27(21,6)28(18,7)17-23(29)31/h8,19-22,30,32H,9-17H2,1-7H3/t19-,20-,21+,22-,26-,27+,28+,29+/m0/s1

InChIKey

InChIKey=DNIUVLCJWDCWGK-VHNCRUBHSA-N

SMILES

C[C@]12[C@@]3(C)[C@@]([C@]4(C)[C@@](CC3)(C(C)(C)[C@@H](O)CC4)[H])(CC=C1[C@]5([C@@](O)(C(=O)C2)CCC(C)(C)C5)[H])[H]

Canonical SMILES

O=C1CC2(C(=CCC3C4(C)CCC(O)C(C)(C)C4CCC32C)C5CC(C)(C)CCC15O)C

Other Names for this Substance

  • 28-Norolean-12-en-16-one, 3,17-dihydroxy-, (3β)-
  • (3β)-3,17-Dihydroxy-28-norolean-12-en-16-one
  • Camellenodiol