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Benz[g]indolo[2,3-a]quinolizine, yohimban-16-carboxylic acid deriv.
SpectraBase Compound ID GSVs3OIa6b0
InChI InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3/t12-,15-,17-,18+,19-/m0/s1
InChIKey BLGXFZZNTVWLAY-CCZXDCJGSA-N
Mol Weight 354.45 g/mol
Molecular Formula C21H26N2O3
Exact Mass 354.194343 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2c9Q6WA7nM
Name Benz[g]indolo[2,3-a]quinolizine, yohimban-16-carboxylic acid deriv.
CAS Registry Number 59952-53-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26N2O3
InChI InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3/t12-,15-,17-,18+,19-/m0/s1
InChIKey BLGXFZZNTVWLAY-CCZXDCJGSA-N
Molecular Weight 354.450 g/mol
SMILES [nH]1c2ccccc2c2c1[C@@]1(C[C@@]3([C@@]([C@@](CC[C@]3(CN1CC2)[H])(O)[H])(C(=O)OC)[H])[H])[H]
SPLASH splash10-0udi-0309000000-a46ec8ac1a5d300e00be
Source of Spectrum K-109-1746-0
Synonyms Methyl (1S,15R,18R,19S,20S)-18-hydroxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate Methyl (1S,15R,18R,19S,20S)-18-oxidanyl-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate
Wiley ID 1344748