(3α,4α,16β)-4,9-Epoxycevane-3,4,12,14,16,17,20-heptol

CAS Registry Number®

124-98-1

CAS Name

(3α,4α,16β)-4,9-Epoxycevane-3,4,12,14,16,17,20-heptol

Molecular Formula

C27H43NO8

Molecular Mass

509.63

Cite this Page

(3α,4α,16β)-4,9-Epoxycevane-3,4,12,14,16,17,20-heptol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=124-98-1 (retrieved 2024-11-22) (CAS RN: 124-98-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    165-172 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C27H43NO8/c1-14-4-7-18-22(3,31)26(34)17(12-28(18)11-14)24(33)13-25-16(23(24,32)10-20(26)30)6-5-15-21(25,2)9-8-19(29)27(15,35)36-25/h14-20,29-35H,4-13H2,1-3H3/t14-,15-,16-,17-,18-,19+,20-,21-,22+,23+,24+,25+,26-,27-/m0/s1

InChIKey

InChIKey=MZHXYVMEVBEFAL-CXZGUCMRSA-N

SMILES

C[C@@]12[C@]34[C@]([C@@]5(O)[C@@](O)(C3)[C@]6([C@](O)([C@@H](O)C5)[C@](C)(O)[C@]7(N(C6)C[C@@H](C)CC7)[H])[H])(CC[C@@]1([C@](O)(O4)[C@H](O)CC2)[H])[H]

Canonical SMILES

OC1CCC2(C)C3CCC4C5(O)CC(O)C6(O)C(CN7CC(C)CCC7C6(O)C)C5(O)CC42OC13O

Other Names for this Substance

  • Cevane-3,4,12,14,16,17,20-heptol, 4,9-epoxy-, (3α,4α,16β)-
  • Cevine
  • Cevane-3α,4β,12,14,16β,17,20-heptol, 4,9-epoxy-
  • (3α,4α,16β)-4,9-Epoxycevane-3,4,12,14,16,17,20-heptol
  • Sabadinine

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