Oleanan-28-oic acid, 3-(acetyloxy)-13-hydroxy-12-oxo-, γ-lactone, (3β)-

CAS Registry Number®

35959-11-6

CAS Name

Oleanan-28-oic acid, 3-(acetyloxy)-13-hydroxy-12-oxo-, γ-lactone, (3β)-

Molecular Formula

C32H48O5

Molecular Mass

512.72

Cite this Page

Oleanan-28-oic acid, 3-(acetyloxy)-13-hydroxy-12-oxo-, γ-lactone, (3β)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=35959-11-6 (retrieved 2024-11-08) (CAS RN: 35959-11-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    288 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C32H48O5/c1-19(33)36-24-10-11-28(6)20(27(24,4)5)9-12-29(7)21(28)17-23(34)32-22-18-26(2,3)13-15-31(22,25(35)37-32)16-14-30(29,32)8/h20-22,24H,9-18H2,1-8H3/t20-,21+,22+,24-,28-,29+,30-,31-,32+/m0/s1

InChIKey

InChIKey=CWTOUABHZIFLIH-INUMUNBOSA-N

SMILES

C[C@]12[C@@]3([C@]4([C@@](C(=O)O3)(CC1)CCC(C)(C)C4)[H])C(=O)C[C@]5([C@@]2(C)CC[C@@]6([C@]5(C)CC[C@H](OC(C)=O)C6(C)C)[H])[H]

Canonical SMILES

O=C(OC1CCC2(C)C3CC(=O)C45OC(=O)C6(CCC(C)(C)CC46)CCC5(C)C3(C)CCC2C1(C)C)C

Other Names for this Substance

  • Oleanan-28-oic acid, 3-(acetyloxy)-13-hydroxy-12-oxo-, γ-lactone, (3β)-
  • Oleanan-28-oic acid, 3β,13-dihydroxy-12-oxo-, γ-lactone, acetate
  • 2H,5H-14a,4a-(Epoxymethano)picene, oleanan-28-oic acid deriv.

CAS INSIGHTSTM
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