Oleana-11,13(18)-dien-29-oic acid, 3,22,23-trihydroxy-, γ-lactone, (3β,4β,20β,22β)-

CAS Registry Number®

111150-27-7

CAS Name

Oleana-11,13(18)-dien-29-oic acid, 3,22,23-trihydroxy-, γ-lactone, (3β,4β,20β,22β)-

Molecular Formula

C30H44O4

Molecular Mass

468.67

Cite this Page

Oleana-11,13(18)-dien-29-oic acid, 3,22,23-trihydroxy-, γ-lactone, (3β,4β,20β,22β)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=111150-27-7 (retrieved 2024-11-12) (CAS RN: 111150-27-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    302-303 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C30H44O4/c1-25-15-19-18-7-8-21-27(3)11-10-22(32)28(4,17-31)20(27)9-12-30(21,6)29(18,5)14-13-26(19,2)23(16-25)34-24(25)33/h7-8,20-23,31-32H,9-17H2,1-6H3/t20-,21-,22+,23-,25-,26-,27+,28-,29-,30-/m1/s1

InChIKey

InChIKey=RIARKSMMKCXBML-SLMNGXHASA-N

SMILES

C[C@]12[C@@]3(C)C(=C4[C@@](C)(CC3)[C@]5(C[C@@](C)(C4)C(=O)O5)[H])C=C[C@@]1([C@]6(C)[C@@](CC2)([C@](CO)(C)[C@@H](O)CC6)[H])[H]

Canonical SMILES

O=C1OC2CC1(C)CC3=C4C=CC5C6(C)CCC(O)C(C)(CO)C6CCC5(C)C4(C)CCC32C

Other Names for this Substance

  • Oleana-11,13(18)-dien-29-oic acid, 3,22,23-trihydroxy-, γ-lactone, (3β,4β,20β,22β)-
  • 4,2-(Epoxymethano)picene, oleana-11,13(18)-dien-29-oic acid deriv.
  • Uralenolide

CAS INSIGHTSTM
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