PCIDB

KNApSAcK Metabolite C00008982

Metabolite

KNApSAcK Entry

id C00008982
Name Triphyllin A
CAS RN 101395-02-2
Standard InChI InChI=1S/C30H40O16/c1-11-26(45-29-24(39)22(37)20(35)17(9-32)43-29)14(8-31)28(46-30-25(40)23(38)21(36)18(10-33)44-30)19-15(34)7-16(42-27(11)19)12-3-5-13(41-2)6-4-12/h3-6,15-18,20-25,29-40H,7-10H2,1-2H3/t15-,16+,17?,18?,20+,21+,22-,23-,24?,25?,29-,30-/m0/s1
Standard InChI (Main Layer) InChI=1S/C30H40O16/c1-11-26(45-29-24(39)22(37)20(35)17(9-32)43-29)14(8-31)28(46-30-25(40)23(38)21(36)18(10-33)44-30)19-15(34)7-16(42-27(11)19)12-3-5-13(41-2)6-4-12/h3-6,15-18,20-25,29-40H,7-10H2,1-2H3

Cluster

Phytochemical cluster
KCF-S cluster No. 152

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL427819

KEGG

By LinkDB

CTD

By CAS RN