α-Amyrenone

CAS Registry Number®

638-96-0

CAS Name

α-Amyrenone

Molecular Formula

C30H48O

Molecular Mass

424.70

Cite this Page

α-Amyrenone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=638-96-0 (retrieved 2024-11-24) (CAS RN: 638-96-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    125-126 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C30H48O/c1-19-11-14-27(5)17-18-29(7)21(25(27)20(19)2)9-10-23-28(6)15-13-24(31)26(3,4)22(28)12-16-30(23,29)8/h9,19-20,22-23,25H,10-18H2,1-8H3/t19-,20+,22+,23-,25+,27-,28+,29-,30-/m1/s1

InChIKey

InChIKey=DIFWJJFSELKWGA-IPQOMUISSA-N

SMILES

C[C@]12[C@@]3(C)C([C@]4([C@@](C)(CC3)CC[C@@H](C)[C@@H]4C)[H])=CC[C@@]1([C@]5(C)[C@@](CC2)(C(C)(C)C(=O)CC5)[H])[H]

Canonical SMILES

O=C1CCC2(C)C(CCC3(C)C2CC=C4C5C(C)C(C)CCC5(C)CCC43C)C1(C)C

Other Names for this Substance

  • Urs-12-en-3-one
  • α-Amyrenone
  • α-Amyrone
  • 3-Oxours-12-ene
  • α-Amirone

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