β-Amyrin

CAS Registry Number®

559-70-6
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CAS Name

β-Amyrin

Molecular Formula

C30H50O

Molecular Mass

426.72

Cite this Page

β-Amyrin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=559-70-6 (retrieved 2024-04-19) (CAS RN: 559-70-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    197 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C30H50O/c1-25(2)15-16-27(5)17-18-29(7)20(21(27)19-25)9-10-23-28(6)13-12-24(31)26(3,4)22(28)11-14-30(23,29)8/h9,21-24,31H,10-19H2,1-8H3/t21-,22-,23+,24-,27+,28-,29+,30+/m0/s1

InChIKey

InChIKey=JFSHUTJDVKUMTJ-QHPUVITPSA-N

SMILES

C[C@]12[C@@]3(C)C([C@]4([C@@](C)(CC3)CCC(C)(C)C4)[H])=CC[C@@]1([C@]5(C)[C@@](CC2)(C(C)(C)[C@@H](O)CC5)[H])[H]

Canonical SMILES

OC1CCC2(C)C(CCC3(C)C2CC=C4C5CC(C)(C)CCC5(C)CCC43C)C1(C)C

Other Names for this Substance

  • Olean-12-en-3-ol, (3β)-
  • Olean-12-en-3β-ol
  • (3β)-Olean-12-en-3-ol
  • β-Amyrenol
  • β-Amyrin

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