Plicamine

AlkaPlorer ID: AK310734

Synonym: None

IUPAC Name: 12-[2-(4-hydroxyphenyl)ethyl]-18-methoxy-15-methyl-5,7-dioxa-12,15-diazapentacyclo[11.7.0.01,16.02,10.04,8]icosa-2,4(8),9,19-tetraene-11,14-dione

Structure

SMILES: COC1C=CC23C4=CC5=C(C=C4C(=O)N(CCC4=CC=C(O)C=C4)C2C(=O)N(C)C3C1)OCO5

copy

InChI: InChI=1S/C26H26N2O6/c1-27-22-11-17(32-2)7-9-26(22)19-13-21-20(33-14-34-21)12-18(19)24(30)28(23(26)25(27)31)10-8-15-3-5-16(29)6-4-15/h3-7,9,12-13,17,22-23,29H,8,10-11,14H2,1-2H3

copy

InChIKey: SWPVBBHHDCMHLN-UHFFFAOYSA-N

copy

Properties Information

Molecule Weight: 462.5020000000002

TPSA: 88.54

MolLogP: 2.2413

Number of H-Donors: 1

Number of H-Acceptors: 6

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information