(1R,3Z,4R,4aS,11bR,12aS,13S)-3,4,4a,5,12,12a-Hexahydro-8,10,11-trimethoxy-3-(2-methoxyethylidene)-4,1,11b-ethanylylidene-2H-pyrido[2′,3′:5,6]oxepino[2,3-b]indole

CAS Registry Number®

34274-91-4
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CAS Name

(1R,3Z,4R,4aS,11bR,12aS,13S)-3,4,4a,5,12,12a-Hexahydro-8,10,11-trimethoxy-3-(2-methoxyethylidene)-4,1,11b-ethanylylidene-2H-pyrido[2′,3′:5,6]oxepino[2,3-b]indole

Molecular Formula

C23H28N2O5

Molecular Mass

412.48

Cite this Page

(1R,3Z,4R,4aS,11bR,12aS,13S)-3,4,4a,5,12,12a-Hexahydro-8,10,11-trimethoxy-3-(2-methoxyethylidene)-4,1,11b-ethanylylidene-2H-pyrido[2′,3′:5,6]oxepino[2,3-b]indole.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=34274-91-4 (retrieved 2024-04-28) (CAS RN: 34274-91-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    133-134 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C23H28N2O5/c1-26-6-5-12-10-25-15-9-23-18(25)7-13(12)14(15)11-30-22(23)24-20-16(27-2)8-17(28-3)21(29-4)19(20)23/h5,8,13-15,18H,6-7,9-11H2,1-4H3/b12-5+/t13-,14-,15-,18-,23-/m0/s1

InChIKey

InChIKey=RIMDDIPKIZTBHU-MTPHOHJNSA-N

SMILES

O(C)C1=C2[C@@]34[C@]5([N@]6[C@@](C3)([C@]([C@@](C5)(\C(=C\COC)\C6)[H])(COC4=NC2=C(OC)C=C1OC)[H])[H])[H]

Canonical SMILES

N1=C2OCC3C4C(=CCOC)CN5C3CC2(C6=C1C(OC)=CC(OC)=C6OC)C5C4

Other Names for this Substance

  • 4,1,11b-Ethanylylidene-2H-pyrido[2′,3′:5,6]oxepino[2,3-b]indole, 3,4,4a,5,12,12a-hexahydro-8,10,11-trimethoxy-3-(2-methoxyethylidene)-, (1R,3Z,4R,4aS,11bR,12aS,13S)-
  • Gardneramine oxindole, 1,2-didehydro-2-deoxo-17-deoxy-2,17-epoxy-
  • (1R,3Z,4R,4aS,11bR,12aS,13S)-3,4,4a,5,12,12a-Hexahydro-8,10,11-trimethoxy-3-(2-methoxyethylidene)-4,1,11b-ethanylylidene-2H-pyrido[2′,3′:5,6]oxepino[2,3-b]indole
  • Gardneramine
  • 4,1,11b-Ethanylylidene-2H-pyrido[2′,3′:5,6]oxepino[2,3-b]indole, 3,4,4a,5,12,12a-hexahydro-8,10,11-trimethoxy-3-(2-methoxyethylidene)-, [1R-(1α,3Z,4α,4aβ,11bα,12aβ,13S*)]-

Deleted or Replaced CAS Registry Numbers

11052-11-2, 33193-71-4

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