13-Hydroxylupanine; E-Cinnamoyl 

AlkaPlorer ID: AK301338

Synonym: trans-13-Cinnamoyloxylupanine 

IUPAC Name: (14-oxo-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadecan-4-yl) (E)-3-phenylprop-2-enoate

Structure

SMILES: O=C(/C=C/C1=CC=CC=C1)OC1CCN2CC3CC(CN4C(=O)CCCC34)C2C1

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InChI: InChI=1S/C24H30N2O3/c27-23-8-4-7-21-18-13-19(16-26(21)23)22-14-20(11-12-25(22)15-18)29-24(28)10-9-17-5-2-1-3-6-17/h1-3,5-6,9-10,18-22H,4,7-8,11-16H2/b10-9+

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InChIKey: PUFYZCKVLOYPHL-MDZDMXLPSA-N

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Reference

PubChem CID: 14109024

CAS: 5835-04-1

Properties Information

Molecule Weight: 394.5150000000002

TPSA: 49.85

MolLogP: 3.1068000000000016

Number of H-Donors: 0

Number of H-Acceptors: 4

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information