(+)-Cerulenin

CAS Registry Number®

17397-89-6
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CAS Name

(+)-Cerulenin

Molecular Formula

C12H17NO3

Molecular Mass

223.27

Cite this Page

(+)-Cerulenin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=17397-89-6 (retrieved 2024-03-28) (CAS RN: 17397-89-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    93.5 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C12H17NO3/c1-2-3-4-5-6-7-8-9(14)10-11(16-10)12(13)15/h2-3,5-6,10-11H,4,7-8H2,1H3,(H2,13,15)/b3-2+,6-5+/t10-,11-/m1/s1

InChIKey

InChIKey=GVEZIHKRYBHEFX-NQQPLRFYSA-N

SMILES

C(CC/C=C/C/C=C/C)(=O)[C@@H]1[C@H](C(N)=O)O1

Canonical SMILES

O=C(N)C1OC1C(=O)CCC=CCC=CC

Other Names for this Substance

  • 2-Oxiranecarboxamide, 3-[(4E,7E)-1-oxo-4,7-nonadien-1-yl]-, (2R,3S)-
  • 7,10-Dodecadienamide, 2,3-epoxy-4-oxo-
  • Oxiranecarboxamide, 3-(1-oxo-4,7-nonadienyl)-, [2R-[2α,3α(4E,7E)]]-
  • Oxiranecarboxamide, 3-[(4E,7E)-1-oxo-4,7-nonadienyl]-, (2R,3S)-
  • (2R,3S)-3-[(4E,7E)-1-Oxo-4,7-nonadien-1-yl]-2-oxiranecarboxamide

Deleted or Replaced CAS Registry Numbers

11052-24-7, 23557-85-9

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