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20,21-Dinoreburnamenine-14-carboxylic acid, 14,15-dihydro-14-hydroxy-18-(1-hydroxyethyl)-, methyl ester, [14.alpha.,18.alpha.(S)]-
SpectraBase Compound ID BPiVPqSpv56
InChI InChI=1S/C21H26N2O4/c1-12(24)14-9-13-10-21(26,20(25)27-2)23-17-6-4-3-5-15(17)16-7-8-22(11-14)18(13)19(16)23/h3-6,12-14,18,24,26H,7-11H2,1-2H3/t12?,13?,14-,18?,21-/m0/s1
InChIKey UKQXOQIRZSCMSF-ZNBYQDPSSA-N
Mol Weight 370.45 g/mol
Molecular Formula C21H26N2O4
Exact Mass 370.189257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DqLvRGqkXQR
Name 20,21-Dinoreburnamenine-14-carboxylic acid, 14,15-dihydro-14-hydroxy-18-(1-hydroxyethyl)-, methyl ester, [14.alpha.,18.alpha.(S)]-
CAS Registry Number 90702-15-1
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26N2O4
InChI InChI=1S/C21H26N2O4/c1-12(24)14-9-13-10-21(26,20(25)27-2)23-17-6-4-3-5-15(17)16-7-8-22(11-14)18(13)19(16)23/h3-6,12-14,18,24,26H,7-11H2,1-2H3/t12?,13?,14-,18?,21-/m0/s1
InChIKey UKQXOQIRZSCMSF-ZNBYQDPSSA-N
Molecular Weight 370.449 g/mol
SMILES OC([C@]1(CC2C3N(CCc4c3[n]([C@](C2)(C(=O)OC)O)c2c4cccc2)C1)[H])C
SPLASH splash10-06di-0039000000-3767fe67b5535c8485dc
Source of Spectrum F-40-746-0
Synonyms 19S-hydroxy-tacamine 1H-Indolo[3,2,1-de]pyrido[3,2,1-ij][1,5]naphthyridine, 20,21-dinoreburnamenine-14-carboxylic acid deriv. Methyl (2S,12S)-12-hydroxy-2-(1-hydroxyethyl)-2,3,5,6,12,13,13a,13b-octahydro-1H-indolo[3,2,1-de]pyrido[3,2,1-ij][1,5]naphthyridine-12-carboxylate
Wiley ID 1354367