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114027-39-3

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114027-39-3 Structure

114027-39-3 Structure
IdentificationBack Directory
[Name]

HuMantenidine
[CAS]

114027-39-3
[Synonyms]

HuMantenidine
Kumantenidine
14-Hydroxygelsenicine
14-Hydroxyhumantenmine
[Molecular Formula]

C19H22N2O4
[MDL Number]

MFCD26406066
[MOL File]

114027-39-3.mol
[Molecular Weight]

342.39
Chemical PropertiesBack Directory
[Boiling point ]

513.3±60.0 °C(Predicted)
[density ]

1.53±0.1 g/cm3(Predicted)
[solubility ]

Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
[form ]

Powder
[pka]

13.52±0.40(Predicted)
[color ]

White to off-white
[InChIKey]

FLDAHLDTMBMPJD-HCWKNHCHSA-N
[SMILES]

N1(OC)C2=C(C=CC=C2)[C@@]2([C@@]3([H])[C@H](O)[C@@]4([H])C(CC)=N[C@@]([H])(C2)[C@@]4([H])CO3)C1=O
[CAS DataBase Reference]

114027-39-3
Hazard InformationBack Directory
[Uses]

Humantenidine, an indole alkaloid, is isolated from Gelsemium sempervirens.
[References]

[1] Schun Y, et al. Cytotoxic steroids of Gelsemium sempervirens. J Nat Prod. 1987;50(2):195-198. DOI:10.1021/np50050a012
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