Spirostan-3,6,25-triol, (3β,5β,6α,25R)-

CAS Registry Number®

17305-15-6

CAS Name

Spirostan-3,6,25-triol, (3β,5β,6α,25R)-

Molecular Formula

C27H44O5

Molecular Mass

448.64

Cite this Page

Spirostan-3,6,25-triol, (3β,5β,6α,25R)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=17305-15-6 (retrieved 2024-11-24) (CAS RN: 17305-15-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    264-268 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C27H44O5/c1-15-23-22(32-27(15)10-9-24(2,30)14-31-27)13-19-17-12-21(29)20-11-16(28)5-7-25(20,3)18(17)6-8-26(19,23)4/h15-23,28-30H,5-14H2,1-4H3/t15-,16-,17+,18-,19-,20-,21-,22-,23-,24+,25+,26-,27+/m0/s1

InChIKey

InChIKey=ILVZNZHXRYGRGV-UYLOAILUSA-N

SMILES

C[C@@]12[C@@]3([C@](C[C@]1([C@]4([C@](CC2)([C@]5(C)[C@]([C@@H](O)C4)(C[C@@H](O)CC5)[H])[H])[H])[H])(O[C@@]6([C@H]3C)CC[C@@](C)(O)CO6)[H])[H]

Canonical SMILES

OC1CCC2(C)C3CCC4(C)C(CC5OC6(OCC(O)(C)CC6)C(C)C54)C3CC(O)C2C1

Other Names for this Substance

  • Spirostan-3,6,25-triol, (3β,5β,6α,25R)-
  • 5β-Spirostan-3β,6α,25-triol, (25R)-
  • Spiro[8H-naphth[2′,1′:4,5]indeno[2,1-b]furan-8,2′-[2H]pyran], spirostan-3,6,25-triol deriv.
  • Asperagenin

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