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BLGXFZZNTVWLAY-UHFFFAOYSA-N

View entire compound with spectra: 32 NMR, and 14 MS (GC)

BLGXFZZNTVWLAY-UHFFFAOYSA-N
SpectraBase Compound ID 29Fi8LoSvQv
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
InChIKey BLGXFZZNTVWLAY-UHFFFAOYSA-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 Kr0uuBiKtx6
Name Yohimban-16-carboxylic acid, 17-hydroxy-, methyl ester, (16.alpha.,17.alpha.)-
Alternate Name(s) Methyl 17-hydroxyyohimban-16-carboxylate (+)-Yohimbin (+)-Yohimbine (16alpha,17alpha)-17-hydroxy-yohimban-16-carboxylic acid methyl ester .beta.-yohimbine 17-Hydroxy-yohimbane-16-carboxylic acid methyl ester 17-Hydroxyyohimban-16-carboxylic acid methyl ester 2-Hydroxy-1,2,3,4,4a,5,7,8,13,13b,14,14a-dodecahydro-indolo[2',3':3,4]pyrido[1,2-b]isoquinoline-1-carboxylic acid methyl ester Amsonin Amsonine Aphrodine Aphrosol Benz[g]indolo[2,3-a]quinolizine, yohimban-16-carboxylic acid deriv. Corynanthin Corynanthine Corynine Coynanthine Methyl (16alpha,17alpha)-17-hydroxyyohimban-16-carboxylate Methyl (16alpha,17beta)-17-hydroxyyohimban-16-carboxylate Quebrachin Quebrachine Rauhimbin Rauhimbine trans-Quinolizidine yohimbine Yohimban-16-.alpha.-carboxylic acid, 17-.alpha.-hydroxy-, methyl ester Yohimban-16-carboxylic acid, 17-hydroxy-, methyl ester, (16-alpha,17-beta)- Yohimban-16-carboxylic acid, 17-hydroxy-, methyl ester, (16.beta.,17.alpha.)- Yohimban-16-carboxylic acid, 17-hydroxy-, methyl ester, (16alpha,17alpha)- Yohimban-16.beta.-carboxylic acid, 17.alpha.-hydroxy-, methyl ester Yohimbic acid methyl ester Yohimbin Yohimbine Yohimbol-16.alpha.-carboxylic acid, methyl ester Methyl 18-hydroxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate Methyl 18-oxidanyl-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate BRN 0097276 EINECS 205-672-0 EINECS 208-977-7 NSC 93133
CAS Registry Number 146-48-5
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
InChIKey BLGXFZZNTVWLAY-UHFFFAOYSA-N
Molecular Weight 354.450 g/mol
SMILES [nH]1c2ccccc2c2c1C1CC3C(C(CCC3CN1CC2)O)C(=O)OC
SPLASH splash10-0udi-5907000000-223f79b792b10216602b
Source of Spectrum AQ-6-593-16
Wiley ID 1344704