PCIDB

KNApSAcK Metabolite C00002601

Metabolite

KNApSAcK Entry

id C00002601
Name Eucommin A
CAS RN 99633-12-2
Standard InChI InChI=1S/C27H34O12/c1-33-17-6-12(4-5-16(17)29)24-14-10-37-25(15(14)11-36-24)13-7-18(34-2)26(19(8-13)35-3)39-27-23(32)22(31)21(30)20(9-28)38-27/h4-8,14-15,20-25,27-32H,9-11H2,1-3H3/t14-,15-,20?,21+,22-,23?,24+,25+,27-/m0/s1
Standard InChI (Main Layer) InChI=1S/C27H34O12/c1-33-17-6-12(4-5-16(17)29)24-14-10-37-25(15(14)11-36-24)13-7-18(34-2)26(19(8-13)35-3)39-27-23(32)22(31)21(30)20(9-28)38-27/h4-8,14-15,20-25,27-32H,9-11H2,1-3H3

Cluster

Phytochemical cluster No. 22
KCF-S cluster No. 174

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL573786 CHEMBL1076999

KEGG

By LinkDB C10560

CTD

By CAS RN