PCIDB

KNApSAcK Metabolite C00043316

Metabolite

KNApSAcK Entry

id C00043316
Name Bisisodiospyrin
CAS RN 30276-87-0
Standard InChI InChI=1S/C44H26O12/c1-15-9-21-35(43(55)33(15)31-17(3)11-27(49)37-23(45)5-7-25(47)39(31)37)29(51)13-19(41(21)53)20-14-30(52)36-22(42(20)54)10-16(2)34(44(36)56)32-18(4)12-28(50)38-24(46)6-8-26(48)40(32)38/h5-14,49-50,55-56H,1-4H3
Standard InChI (Main Layer) InChI=1S/C44H26O12/c1-15-9-21-35(43(55)33(15)31-17(3)11-27(49)37-23(45)5-7-25(47)39(31)37)29(51)13-19(41(21)53)20-14-30(52)36-22(42(20)54)10-16(2)34(44(36)56)32-18(4)12-28(50)38-24(46)6-8-26(48)40(32)38/h5-14,49-50,55-56H,1-4H3

Cluster

Phytochemical cluster
KCF-S cluster No. 5450

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN