PCIDB

KNApSAcK Metabolite C00010515

Metabolite

KNApSAcK Entry

id C00010515
Name Picroside III
CAS RN 64461-95-6
Standard InChI InChI=1S/C25H30O13/c1-33-14-8-11(2-4-13(14)27)3-5-16(28)35-9-15-19(30)20(31)21(32)24(36-15)37-23-17-12(6-7-34-23)18(29)22-25(17,10-26)38-22/h2-8,12,15,17-24,26-27,29-32H,9-10H2,1H3/b5-3+/t12-,15+,17?,18+,19?,20+,21?,22+,23+,24?,25-/m1/s1
Standard InChI (Main Layer) InChI=1S/C25H30O13/c1-33-14-8-11(2-4-13(14)27)3-5-16(28)35-9-15-19(30)20(31)21(32)24(36-15)37-23-17-12(6-7-34-23)18(29)22-25(17,10-26)38-22/h2-8,12,15,17-24,26-27,29-32H,9-10H2,1H3

Cluster

Phytochemical cluster No. 36
KCF-S cluster No. 287

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

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CTD

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