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Voacamine

Voacamine structure

CAS No:
3371-85-5
Formula:
C43H52N4O5
Chemical Name:
Voacamine
Synonyms:
Ibogamine-18-carboxylic acid,12-methoxy-13-[(3α)-17-methoxy-17-oxovobasan-3-yl]-,methyl ester;Voacamine;6,9-Methano-5H-pyrido[1′,2′:1,2]azepino[4,5-b]indole-6(6aH)-carboxylic acid,3-(14-carboxy-5-ethylidene-2,3,4,5,6,7,8,9-octahydro-3-methyl-2,6-methano-1H-azecino[5,4-b]indol-8-yl)-7-ethyl-7,8,9,10,12,13-hexahydro-2-methoxy-,dimethyl ester;Voacanginine;NSC 82591;MMH 18;Malarex

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Voacamine Basic Attributes

Molecular Weight：

704.89700

Exact Mass：

704.90

EC Number：

222-151-3

Characteristics

PSA：

99.89000

XLogP3：

6.36470

Density：

1.309g/cm3

Melting Point：

220-223 °C (decomp) @ Solvent: Methanol

Refractive Index：

1.674

Computed Properties

Molecular Weight:704.9
XLogP3:6.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:704.39377077
Monoisotopic Mass:704.39377077
Topological Polar Surface Area:99.9
Heavy Atom Count:52
Complexity:1410
Undefined Atom Stereocenter Count:8
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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methyl 12-methoxy-13-(17-methoxy-17-oxovobasan-3alpha-yl)ibogamine-18-carboxylate

CAS No.: 3371-85-5

Content: 99.00%

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Guide of Voacamine

Basic Attributes
Characteristics
Computed Properties
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