PCIDB

KNApSAcK Metabolite C00002583

Metabolite

KNApSAcK Entry

id C00002583
Name (+)-Vestitol / (3S)-Vestitol / (3S)-3,4-Dihydro-3-(2-hydroxy-4-methoxyphenyl)-2H-1-benzopyran-7-ol
CAS RN 20879-05-4
Standard InChI InChI=1S/C16H16O4/c1-19-13-4-5-14(15(18)8-13)11-6-10-2-3-12(17)7-16(10)20-9-11/h2-5,7-8,11,17-18H,6,9H2,1H3/t11-/m1/s1
Standard InChI (Main Layer) InChI=1S/C16H16O4/c1-19-13-4-5-14(15(18)8-13)11-6-10-2-3-12(17)7-16(10)20-9-11/h2-5,7-8,11,17-18H,6,9H2,1H3

Cluster

Phytochemical cluster No. 15
KCF-S cluster No. 73

Link

ChEMBL

By standard InChI CHEMBL252913
By standard InChI Main Layer CHEMBL252913 CHEMBL479145

KEGG

By LinkDB C10540

CTD

By CAS RN