Soyasapogenol A

CAS Registry Number®

508-01-0

CAS Name

Soyasapogenol A

Molecular Formula

C30H50O4

Molecular Mass

474.72

Cite this Page

Soyasapogenol A.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=508-01-0 (retrieved 2024-11-22) (CAS RN: 508-01-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    307-310 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C30H50O4/c1-25(2)16-19-18-8-9-21-27(4)12-11-22(32)28(5,17-31)20(27)10-13-30(21,7)29(18,6)15-14-26(19,3)24(34)23(25)33/h8,19-24,31-34H,9-17H2,1-7H3/t19-,20+,21+,22-,23-,24+,26+,27-,28+,29+,30+/m0/s1

InChIKey

InChIKey=CDDWAYFUFNQLRZ-KJVHGCRFSA-N

SMILES

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

Canonical SMILES

OCC1(C)C(O)CCC2(C)C1CCC3(C)C2CC=C4C5CC(C)(C)C(O)C(O)C5(C)CCC43C

Other Names for this Substance

  • Olean-12-ene-3,21,22,23-tetrol, (3β,4β,21β,22β)-
  • Olean-12-ene-3β,21β,22β,24-tetrol
  • Soyasapogenol A
  • (3β,4β,21β,22β)-Olean-12-ene-3,21,22,23-tetrol

CAS INSIGHTSTM
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