2,6-Methano-1H-azecino[5,4-b]indole-14-carboxylic acid, 5-ethyl-2,3,4,5,6,7,8,9-octahydro-3-methyl-8-oxo-, methyl ester, (2S,5S,6S,14S)-

CAS Registry Number®

2134-98-7
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CAS Name

2,6-Methano-1H-azecino[5,4-b]indole-14-carboxylic acid, 5-ethyl-2,3,4,5,6,7,8,9-octahydro-3-methyl-8-oxo-, methyl ester, (2S,5S,6S,14S)-

Molecular Formula

C21H26N2O3

Molecular Mass

354.44

Cite this Page

2,6-Methano-1H-azecino[5,4-b]indole-14-carboxylic acid, 5-ethyl-2,3,4,5,6,7,8,9-octahydro-3-methyl-8-oxo-, methyl ester, (2S,5S,6S,14S)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2134-98-7 (retrieved 2024-04-23) (CAS RN: 2134-98-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    217-219 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H26N2O3/c1-4-12-11-23(2)17-9-15-13-7-5-6-8-16(13)22-20(15)18(24)10-14(12)19(17)21(25)26-3/h5-8,12,14,17,19,22H,4,9-11H2,1-3H3/t12-,14?,17+,19+/m1/s1

InChIKey

InChIKey=FFVRRQMGGGTQRH-JIZHDCQOSA-N

SMILES

O=C1C2=C(C=3C(N2)=CC=CC3)C[C@]4([C@@H](C(OC)=O)C(C1)([C@H](CC)CN4C)[H])[H]

Canonical SMILES

O=C(OC)C1C2N(C)CC(CC)C1CC(=O)C=3NC=4C=CC=CC4C3C2

Other Names for this Substance

  • 2,6-Methano-1H-azecino[5,4-b]indole-14-carboxylic acid, 5-ethyl-2,3,4,5,6,7,8,9-octahydro-3-methyl-8-oxo-, methyl ester, (2S,5S,6S,14S)-
  • Tabernemontanine
  • Vobasan-17-oic acid, 19,20-dihydro-3-oxo-, methyl ester, (20β)-
  • 20-Epidregamine
  • Tabernaemontanine

View All

Deleted or Replaced CAS Registry Numbers

28645-90-1

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