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(3β,20α)-17α-Hydroxyyohimban-16β-carboxylicacidmethylester

(3β,20α)-17α-Hydroxyyohimban-16β-carboxylicacidmethylester structure

CAS No:
483-09-0
Formula:
C21H26N2O3
Chemical Name:
(3β,20α)-17α-Hydroxyyohimban-16β-carboxylicacidmethylester
Synonyms:
Isorauhimbine;3-Epiisoyohimbine;3-epi-alpha-Yohimbine;CHEMBL465600;SCHEMBL20139010;methyl (1R,15S,18S,19S,20S)-18-hydroxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate;AKOS032962168;ZINC409444133;W1054;Yohimban-16-carboxylic acid, 17-hydroxy-, methyl ester, (3beta,16beta,17alpha,20alpha)-
Categories:
Natural Products > Alkaloids

Description

Methyl 17-hydroxy-20xi-yohimban-16-carboxylate is a yohimban alkaloid, a methyl ester and an organic heteropentacyclic compound.

(3β,20α)-17α-Hydroxyyohimban-16β-carboxylicacidmethylester Basic Attributes

Molecular Weight：

354.44274

Exact Mass：

354.194336

EC Number：

208-977-7

NSC Number：

407306|93133

Characteristics

PSA：

65.56000

XLogP3：

2.20

Density：

1.3±0.1 g/cm3

Boiling Point：

543.0±50.0 °C at 760 mmHg

Flash Point：

282.2±30.1 °C

Refractive Index：

1.661

Computed Properties

Molecular Weight:354.4
XLogP3:2.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:354.19434270
Monoisotopic Mass:354.19434270
Topological Polar Surface Area:65.6
Heavy Atom Count:26
Complexity:555
Undefined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Recommended Suppliers of (3β,20α)-17α-Hydroxyyohimban-16β-carboxylicacidmethylester

Shaanxi Dideu Medichem Co. Ltd Contact Supplier

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(3β,20α)-17α-Hydroxyyohimban-16β-carboxylic acid methyl ester

CAS No.: 483-09-0

Grade: Industrial Grade

Content: 99%

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Guide of (3β,20α)-17α-Hydroxyyohimban-16β-carboxylicacidmethylester

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Basic Attributes
Characteristics
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