3-Epimaslinic acid

CAS Registry Number®

26563-68-8

CAS Name

3-Epimaslinic acid

Molecular Formula

C30H48O4

Molecular Mass

472.70

Cite this Page

3-Epimaslinic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=26563-68-8 (retrieved 2024-11-22) (CAS RN: 26563-68-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    295-297 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C30H48O4/c1-25(2)12-14-30(24(33)34)15-13-28(6)18(19(30)16-25)8-9-22-27(5)17-20(31)23(32)26(3,4)21(27)10-11-29(22,28)7/h8,19-23,31-32H,9-17H2,1-7H3,(H,33,34)/t19-,20+,21-,22+,23+,27-,28+,29+,30-/m0/s1

InChIKey

InChIKey=MDZKJHQSJHYOHJ-HFYZCPLSSA-N

SMILES

C[C@]12[C@@]3(C)C([C@]4([C@@](C(O)=O)(CC3)CCC(C)(C)C4)[H])=CC[C@@]1([C@]5(C)[C@@](CC2)(C(C)(C)[C@H](O)[C@H](O)C5)[H])[H]

Canonical SMILES

O=C(O)C12CCC(C)(C)CC2C3=CCC4C5(C)CC(O)C(O)C(C)(C)C5CCC4(C)C3(C)CC1

Other Names for this Substance

  • Olean-12-en-28-oic acid, 2,3-dihydroxy-, (2α,3α)-
  • Olean-12-en-28-oic acid, 2α,3α-dihydroxy-
  • (2α,3α)-2,3-Dihydroxyolean-12-en-28-oic acid
  • 2α,3α-Dihydroxyolean-12-en-28-oic acid
  • 3-Epimaslinic acid

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