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Carpaine

Carpaine structure

CAS No:
3463-92-1
Formula:
C28H50N2O4
Chemical Name:
Carpaine
Synonyms:
2,15-Dioxa-12,25-diazatricyclo[22.2.2.211,14]triacontane-3,16-dione,13,26-dimethyl-,(1S,11R,13S,14S,24R,26S)-;Carpaine;2,15-Dioxa-12,25-diazatricyclo[22.2.2.211,14]triacontane-3,16-dione,13,26-dimethyl-,[1S-(1R*,11S*,13R*,14R*,24S*,26R*)]-;(1S,11R,13S,14S,24R,26S)-13,26-Dimethyl-2,15-dioxa-12,25-diazatricyclo[22.2.2.211,14]triacontane-3,16-dione;[1S-(1R*,11S*,13R*,14R*,24S*,26R*)]-13,26-Dimethyl-2,15-dioxa-12,25-diazatricyclo[22.2.2.211,14]triacontane-3,16-dione;(+)-Carpaine;32771-57-6;741607-91-0
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

Description

ChEBI: An alkaloid that forms a major component of the papaya leaves and has been shown to exhibit cardiovascular effects.

Carpaine is an alkaloid that forms a major component of the papaya leaves and has been shown to exhibit cardiovascular effects. It has a role as a plant metabolite and a cardiovascular drug. It is an alkaloid and a macrodiolide.

Carpaine Basic Attributes

Molecular Weight：

478.718

Exact Mass：

478.71

EC Number：

222-414-2

UNII：

VLR223H4QP

Characteristics

PSA：

76.7

XLogP3：

6.3

Density：

1.0566 (rough estimate)

Melting Point：

121 °C

Drug Information

MeSH Entry Terms：

carpaine

Computed Properties

Molecular Weight:478.7
XLogP3:6.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Exact Mass:478.37705808
Monoisotopic Mass:478.37705808
Topological Polar Surface Area:76.7
Heavy Atom Count:34
Complexity:561
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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