Hippuristanol

CAS Registry Number®

80442-78-0
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CAS Name

Hippuristanol

Molecular Formula

C28H46O5

Molecular Mass

462.66

Cite this Page

Hippuristanol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=80442-78-0 (retrieved 2024-04-26) (CAS RN: 80442-78-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C28H46O5/c1-15-13-28(33-24(15,2)3)27(6,31)23-21(32-28)12-19-18-8-7-16-11-17(29)9-10-25(16,4)22(18)20(30)14-26(19,23)5/h15-23,29-31H,7-14H2,1-6H3/t15-,16-,17+,18-,19-,20-,21-,22+,23-,25-,26-,27+,28+/m0/s1

InChIKey

InChIKey=HPHXKNOXVBFETI-SHCCRYCOSA-N

SMILES

C[C@]1(O)[C@@]2(O[C@@]3([C@]1([C@]4(C)[C@@](C3)([C@]5([C@]([C@@H](O)C4)([C@]6(C)[C@@](CC5)(C[C@H](O)CC6)[H])[H])[H])[H])[H])[H])C[C@H](C)C(C)(C)O2

Canonical SMILES

OC1CCC2(C)C(CCC3C4CC5OC6(OC(C)(C)C(C)C6)C(O)(C)C5C4(C)CC(O)C32)C1

Other Names for this Substance

  • Furostan-3,11,20-triol, 22,25-epoxy-24-methyl-, (3α,5α,11β,22β,24S)-
  • (3α,5α,11β,22β,24S)-22,25-Epoxy-24-methylfurostan-3,11,20-triol
  • Hippuristanol

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