(3β,4α,7α,15α,16β)-4,9-Epoxycevane-3,4,7,14,15,16,20-heptol

CAS Registry Number®

508-65-6

CAS Name

(3β,4α,7α,15α,16β)-4,9-Epoxycevane-3,4,7,14,15,16,20-heptol

Molecular Formula

C27H43NO8

Molecular Mass

509.63

Cite this Page

(3β,4α,7α,15α,16β)-4,9-Epoxycevane-3,4,7,14,15,16,20-heptol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=508-65-6 (retrieved 2024-11-23) (CAS RN: 508-65-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    220 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C27H43NO8/c1-12-4-5-17-24(3,33)19-13(11-28(17)10-12)14-9-25-21(26(14,34)22(32)20(19)31)15(29)8-16-23(25,2)7-6-18(30)27(16,35)36-25/h12-22,29-35H,4-11H2,1-3H3/t12-,13-,14-,15+,16-,17-,18-,19+,20+,21+,22-,23-,24+,25+,26-,27-/m0/s1

InChIKey

InChIKey=RNPABQVCNAUEIY-GUQYYFCISA-N

SMILES

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

Canonical SMILES

OC1CC2C3(O)OC4(CC5C6CN7CC(C)CCC7C(O)(C)C6C(O)C(O)C5(O)C14)C2(C)CCC3O

Other Names for this Substance

  • Cevane-3,4,7,14,15,16,20-heptol, 4,9-epoxy-, (3β,4α,7α,15α,16β)-
  • Cevane-3β,4β,7α,14,15α,16β,20-heptol, 4,9-epoxy-
  • Germine
  • (3β,4α,7α,15α,16β)-4,9-Epoxycevane-3,4,7,14,15,16,20-heptol
  • Germin

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