Cornigerine

CAS Registry Number®

6877-25-4

CAS Name

Cornigerine

Molecular Formula

C21H21NO6

Molecular Mass

383.39

Cite this Page

Cornigerine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=6877-25-4 (retrieved 2024-11-24) (CAS RN: 6877-25-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    270 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H21NO6/c1-11(23)22-15-6-4-12-8-18-20(28-10-27-18)21(26-3)19(12)13-5-7-17(25-2)16(24)9-14(13)15/h5,7-9,15H,4,6,10H2,1-3H3,(H,22,23)/t15-/m0/s1

InChIKey

InChIKey=DCYAJVOKJAFSES-HNNXBMFYSA-N

SMILES

O(C)C1=C2C=3C([C@@H](NC(C)=O)CCC2=CC4=C1OCO4)=CC(=O)C(OC)=CC3

Canonical SMILES

O=C1C=C2C(=CC=C1OC)C3=C(OC)C=4OCOC4C=C3CCC2NC(=O)C

Other Names for this Substance

  • Acetamide, N-[(6S)-4,6,7,8-tetrahydro-3,13-dimethoxy-4-oxoheptaleno[1,2-f][1,3]benzodioxol-6-yl]-
  • Cornigerine
  • Acetamide, N-(4,6,7,8-tetrahydro-3,13-dimethoxy-4-oxoheptaleno[1,2-f][1,3]benzodioxol-6-yl)-, (S)-
  • Heptaleno[1,2-f][1,3]benzodioxole, acetamide deriv.
  • N-[(6S)-4,6,7,8-Tetrahydro-3,13-dimethoxy-4-oxoheptaleno[1,2-f][1,3]benzodioxol-6-yl]acetamide

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