Primulagenin A

CAS Registry Number®

465-95-2
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CAS Name

Primulagenin A

Molecular Formula

C30H50O3

Molecular Mass

458.72

Cite this Page

Primulagenin A.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=465-95-2 (retrieved 2024-04-29) (CAS RN: 465-95-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    240-242 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C30H50O3/c1-25(2)14-15-30(18-31)20(16-25)19-8-9-22-27(5)12-11-23(32)26(3,4)21(27)10-13-28(22,6)29(19,7)17-24(30)33/h8,20-24,31-33H,9-18H2,1-7H3/t20-,21-,22+,23-,24+,27-,28+,29+,30+/m0/s1

InChIKey

InChIKey=YHGVYECWZWIVJC-TVZJSHMMSA-N

SMILES

C[C@]12C([C@]3([C@@](CO)([C@H](O)C1)CCC(C)(C)C3)[H])=CC[C@]4([C@@]2(C)CC[C@@]5([C@]4(C)CC[C@H](O)C5(C)C)[H])[H]

Canonical SMILES

OCC12CCC(C)(C)CC2C3=CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C3(C)CC1O

Other Names for this Substance

  • Olean-12-ene-3,16,28-triol, (3β,16α)-
  • Primulagenin A
  • Olean-12-ene-3β,16α,28-triol
  • (3β,16α)-Olean-12-ene-3,16,28-triol
  • Genin A (Primula)

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