Picrinine

CAS Registry Number®

4684-32-6
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CAS Name

Picrinine

Molecular Formula

C20H22N2O3

Molecular Mass

338.40

Cite this Page

Picrinine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=4684-32-6 (retrieved 2024-05-02) (CAS RN: 4684-32-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    222-224 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C20H22N2O3/c1-3-11-10-22-15-8-12(11)17(18(23)24-2)19-9-16(22)25-20(15,19)21-14-7-5-4-6-13(14)19/h3-7,12,15-17,21H,8-10H2,1-2H3/b11-3-/t12-,15-,16-,17-,19-,20-/m0/s1

InChIKey

InChIKey=BDXYPHKGNUGUFG-VETGLWQVSA-N

SMILES

C(OC)(=O)[C@H]1[C@]23[C@@]4([C@]5(N([C@](C2)(O4)[H])C\C(=C\C)\[C@@]1(C5)[H])[H])NC=6C3=CC=CC6

Canonical SMILES

O=C(OC)C1C2C(=CC)CN3C4OC5(NC=6C=CC=CC6C15C4)C3C2

Other Names for this Substance

  • 2H,12H-6,12a-Epoxy-2,7a-methanoindolo[2,3-a]quinolizine-14-carboxylic acid, 3-ethylidene-1,3,4,6,7,12b-hexahydro-, methyl ester, (2R,3E,6S,7aR,12aR,12bS,14R)-
  • Picrinine
  • Akuammilan-17-oic acid, 2,5-epoxy-1,2-dihydro-, methyl ester, (2α,5α)-
  • Picraline, deacetyldeformo-
  • 16-De[(acetyloxy)methyl]picraline

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Deleted or Replaced CAS Registry Numbers

20045-04-9

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