Molecular Identity
Cephalotaxine
(2S,3S,6R)-4-methoxy-16,18-dioxa-10-azapentacyclo[11.7.0.02,6.06,10.015,19]icosa-1(20),4,13,15(19)-tetraen-3-ol
PubChem CID: 65305
Cephalotaxine is a benzazepine alkaloid isolated from Cephalotaxus harringtonia. It is a secondary alcohol, an organic heteropentacyclic compound, a benzazepine alkaloid, a benzazepine alkaloid fundamental parent, an enol ether, a tertiary amino compound and a cyclic acetal.
2D Structure
Properties
C18H21NO4
Molecular Formula
315.40
Molecular Weight
g/mol
315.1471
Exact Mass
Da
0.2
XLogP
Drug-like (Lipinski: < 5)
51.2
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
5
H-Bond Acceptors
523
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Cephalotaxine24316-19-6(-)-CephalotaxineOmacetaxine84MI6OYN4ZCHEBI:3540NSC-128487NSC-245454(2S,3S,6R)-4-methoxy-16,18-dioxa-10-azapentacyclo[11.7.0.02,6.06,10.015,19]icosa-1(20),4,13,15(19)-tetraen-3-ol(2S,3S,6R)-4-methoxy-16,18-dioxa-10-azapentacyclo(11.7.0.02,6.06,10.015,19)icosa-1(20),4,13,15(19)-tetraen-3-olRefChem:56711DTXCID4028206636-631-9DTXSID3048231Cephalotaxlen
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Cephalotaxine
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