Communesin B

CAS Registry Number®

148439-46-7
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CAS Name

Communesin B

Molecular Formula

C32H36N4O2

Molecular Mass

508.65

Cite this Page

Communesin B.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=148439-46-7 (retrieved 2024-04-27) (CAS RN: 148439-46-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C32H36N4O2/c1-5-6-7-15-24(37)35-18-16-31-21-12-8-9-13-22(21)33-28-32(31)17-19-36(29(31)35)26(27-30(2,3)38-27)20-11-10-14-23(25(20)32)34(28)4/h5-15,26-29,33H,16-19H2,1-4H3/b6-5+,15-7+/t26-,27+,28+,29+,31-,32-/m0/s1

InChIKey

InChIKey=XZFSMUXVAYCHFO-RPCCRITPSA-N

SMILES

CN1[C@@]2([C@]34[C@]5([C@@]([N@@](CC3)[C@@](C6=C4C1=CC=C6)([C@@]7([C@](C)(C)O7)[H])[H])(N(C(/C=C/C=C/C)=O)CC5)[H])C=8C(N2)=CC=CC8)[H]

Canonical SMILES

O=C(C=CC=CC)N1CCC23C=4C=CC=CC4NC5N(C6=CC=CC7=C6C53CCN(C7C8OC8(C)C)C12)C

Other Names for this Substance

  • 2,4-Hexadien-1-one, 1-[(3aR,8aR,13bR,16R,16aS,17S)-17-[(2R)-3,3-dimethyl-2-oxiranyl]-2,3,8a,9,14,15-hexahydro-9-methyl-13,16-methano-8H,16H-pyrrolo[2′,3′:2,3]pyrido[4,3-o]quinindolin-1(16aH)-yl]-, (2E,4E)-
  • 13,16-Methano-8H,16H-pyrrolo[2′,3′:2,3]pyrido[4,3-o]quinindoline, 17-[(2R)-3,3-dimethyloxiranyl]-1,2,3,8a,9,14,15,16a-octahydro-9-methyl-1-[(2E,4E)-1-oxo-2,4-hexadienyl]-, (3aR,8aR,13bR,16R,16aS,17S)-
  • (2E,4E)-1-[(3aR,8aR,13bR,16R,16aS,17S)-17-[(2R)-3,3-Dimethyl-2-oxiranyl]-2,3,8a,9,14,15-hexahydro-9-methyl-13,16-methano-8H,16H-pyrrolo[2′,3′:2,3]pyrido[4,3-o]quinindolin-1(16aH)-yl]-2,4-hexadien-1-one
  • Communesin B
  • (+)-Communesin B

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Deleted or Replaced CAS Registry Numbers

395667-45-5, 2376114-07-5

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