Yohimbine

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Systematic / IUPAC Name: Methyl 17-hydroxyyohimban-16-carboxylate

ID: Reference961

Other Names: Yohimban-16-carboxylic acid, 17-hydroxy-, methyl ester, (16α,17α)-;
17-Hydroxyyohimban-16-carboxylic acid methyl ester;
Methyl 17α-hydroxyyohimban-16α-carboxylate;
17α-Hydroxyyohimban-16α-carboxylic acid methyl ester;
(16α,17α)-17-Hydroxyyohimban-16-carboxylic acid methyl ester ; more

Formula: C21H26N2O3

Class: Therapeutics/Prescription Drugs

Spectral Data

Yohimbine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap; Q Exactive Plus Orbitrap
No. of Spectral Trees 2
No. of Spectra 120
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 10/14/2016 8:43:04 AM
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Identificators

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
InChI Key BLGXFZZNTVWLAY-SCYLSFHTSA-N
Canonical SMILES
CAS 146485
Splash
Other Names Yohimban-16-carboxylic acid, 17-hydroxy-, methyl ester, (16α,17α)-;
17-Hydroxyyohimban-16-carboxylic acid methyl ester;
Methyl 17α-hydroxyyohimban-16α-carboxylate;
17α-Hydroxyyohimban-16α-carboxylic acid methyl ester;
(16α,17α)-17-Hydroxyyohimban-16-carboxylic acid methyl ester;
Yohimbin;
Corynine;
Quebrachin;
Quebrachine;
Aphrosol;
Aphrodine;
(+)-Yohimbine

In Other Databases

ChEMBL CHEMBL15245
ChemIDPlus 000146485
KEGG C09256; D08685
Wikipedia Yohimbine
ChemSpider 8622
ChEBI CHEBI:10093
HMDb HMDB15464
PubChem 8969