CID 72834169

AlkaPlorer ID: AK001315

Synonym: None

IUPAC Name: 15-ethylidene-13-(hydroxymethyl)-3,17-diazapentacyclo[12.3.1.02,10.04,9.012,17]octadeca-2(10),4(9),5,7-tetraene-1,7-diol

Structure

SMILES: CC=C1CN2C3CC4=C(C2(CC1C3CO)O)NC5=C4C=C(C=C5)O

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InChI: InChI=1S/C19H22N2O3/c1-2-10-8-21-17-6-13-12-5-11(23)3-4-16(12)20-18(13)19(21,24)7-14(10)15(17)9-22/h2-5,14-15,17,20,22-24H,6-9H2,1H3

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InChIKey: FNKZQZYHQGWZAE-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 326.396

TPSA: 79.72

MolLogP: 1.8336000000000001

Number of H-Donors: 4

Number of H-Acceptors: 4

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information