3-Epidehydropachymic acid

CAS Registry Number®

168293-15-0
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CAS Name

3-Epidehydropachymic acid

Molecular Formula

C33H50O5

Molecular Mass

526.75

Cite this Page

3-Epidehydropachymic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=168293-15-0 (retrieved 2024-08-11) (CAS RN: 168293-15-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    276-278 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C33H50O5/c1-19(2)20(3)10-11-22(29(36)37)28-25(35)18-33(9)24-12-13-26-30(5,6)27(38-21(4)34)15-16-31(26,7)23(24)14-17-32(28,33)8/h12,14,19,22,25-28,35H,3,10-11,13,15-18H2,1-2,4-9H3,(H,36,37)/t22-,25-,26+,27-,28+,31-,32-,33+/m1/s1

InChIKey

InChIKey=RWIALJIVPUCERT-ROLXBSRMSA-N

SMILES

C[C@]12[C@@](C)([C@@]([C@@H](CCC(C(C)C)=C)C(O)=O)([C@H](O)C1)[H])CC=C3C2=CC[C@@]4([C@]3(C)CC[C@@H](OC(C)=O)C4(C)C)[H]

Canonical SMILES

O=C(OC1CCC2(C3=CCC4(C)C(C(O)CC4(C3=CCC2C1(C)C)C)C(C(=O)O)CCC(=C)C(C)C)C)C

Other Names for this Substance

  • Lanosta-7,9(11)-dien-21-oic acid, 3-(acetyloxy)-16-hydroxy-24-methylene-, (3α,16α)-
  • (3α,16α)-3-(Acetyloxy)-16-hydroxy-24-methylenelanosta-7,9(11)-dien-21-oic acid
  • 3-Epidehydropachymic acid
  • 3-epi-Dehydropachymic acid