Olean-12-ene-3,28-diol, 3-hexadecanoate, (3β)-

CAS Registry Number®

19833-13-7

CAS Name

Olean-12-ene-3,28-diol, 3-hexadecanoate, (3β)-

Molecular Formula

C46H80O3

Molecular Mass

681.13

Cite this Page

Olean-12-ene-3,28-diol, 3-hexadecanoate, (3β)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=19833-13-7 (retrieved 2024-11-25) (CAS RN: 19833-13-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C46H80O3/c1-9-10-11-12-13-14-15-16-17-18-19-20-21-22-40(48)49-39-26-27-43(6)37(42(39,4)5)25-28-45(8)38(43)24-23-35-36-33-41(2,3)29-31-46(36,34-47)32-30-44(35,45)7/h23,36-39,47H,9-22,24-34H2,1-8H3/t36-,37-,38+,39-,43-,44+,45+,46+/m0/s1

InChIKey

InChIKey=ZOXWEJMCUKRYDD-XCNRMXNJSA-N

SMILES

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

Canonical SMILES

O=C(OC1CCC2(C)C3CC=C4C5CC(C)(C)CCC5(CO)CCC4(C)C3(C)CCC2C1(C)C)CCCCCCCCCCCCCCC

Other Names for this Substance

  • Olean-12-ene-3,28-diol, 3-hexadecanoate, (3β)-
  • Olean-12-ene-3β,28-diol, 3-palmitate
  • Palmitic acid, 28-hydroxyolean-12-en-3β-yl ester
  • 3β-Palmitoxyolean-12-en-28-ol
  • Erythrodiol 3-monopalmitate

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