PCIDB

KNApSAcK Metabolite C00019918

Metabolite

KNApSAcK Entry

id C00019918
Name Smyrindiol / Smirindiol / (+)-3'-Hydroxymarmesin / (2'S,3'R)-3'-Hydroxymarmesin / (+)-(2S',3'R)-3-Hydroxymarmesin
CAS RN 87725-60-8
Standard InChI InChI=1S/C14H14O5/c1-14(2,17)13-12(16)8-5-7-3-4-11(15)18-9(7)6-10(8)19-13/h3-6,12-13,16-17H,1-2H3/t12-,13+/m1/s1
Standard InChI (Main Layer) InChI=1S/C14H14O5/c1-14(2,17)13-12(16)8-5-7-3-4-11(15)18-9(7)6-10(8)19-13/h3-6,12-13,16-17H,1-2H3

Cluster

Phytochemical cluster No. 25
KCF-S cluster No. 1336

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN