3,4-Dihydro-3-hydroxy-2-methyl-2-(4-methyl-3-pentenyl)-2H-1-benzopyran-6-carboxylic acid; (2R,3S)-form, Amide 

AlkaPlorer ID: AK295806

Synonym: Xiamenmycin C

IUPAC Name: 3-hydroxy-2-methyl-2-(4-methylpent-3-enyl)-3,4-dihydrochromene-6-carboxamide

Structure

SMILES: CC(C)=CCCC1(C)OC2=CC=C(C(=N)O)C=C2CC1O

copy

InChI: InChI=1S/C17H23NO3/c1-11(2)5-4-8-17(3)15(19)10-13-9-12(16(18)20)6-7-14(13)21-17/h5-7,9,15,19H,4,8,10H2,1-3H3,(H2,18,20)

copy

InChIKey: LIJVEWSHDPKZMX-UHFFFAOYSA-N

copy

Properties Information

Molecule Weight: 289.37500000000006

TPSA: 73.54

MolLogP: 3.3708700000000014

Number of H-Donors: 3

Number of H-Acceptors: 3

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information