PCIDB

KNApSAcK Metabolite C00043092

Metabolite

KNApSAcK Entry

id C00043092
Name Triploside A
CAS RN 141544-45-8
Standard InChI InChI=1S/C67H108O31/c1-26-38(72)52(97-57-47(81)51(33(71)24-87-57)96-58-45(79)42(76)49(27(2)91-58)94-56-46(80)50(32(70)23-86-56)95-55-44(78)41(75)34(25-89-55)92-54-43(77)39(73)30(68)21-85-54)48(82)59(90-26)98-53-40(74)31(69)22-88-60(53)93-37-13-14-64(7)35(63(37,5)6)12-15-66(9)36(64)11-10-28-29-20-62(3,4)16-18-67(29,61(83)84)19-17-65(28,66)8/h10,26-27,29-60,68-82H,11-25H2,1-9H3,(H,83,84)
Standard InChI (Main Layer) InChI=1S/C67H108O31/c1-26-38(72)52(97-57-47(81)51(33(71)24-87-57)96-58-45(79)42(76)49(27(2)91-58)94-56-46(80)50(32(70)23-86-56)95-55-44(78)41(75)34(25-89-55)92-54-43(77)39(73)30(68)21-85-54)48(82)59(90-26)98-53-40(74)31(69)22-88-60(53)93-37-13-14-64(7)35(63(37,5)6)12-15-66(9)36(64)11-10-28-29-20-62(3,4)16-18-67(29,61(83)84)19-17-65(28,66)8/h10,26-27,29-60,68-82H,11-25H2,1-9H3,(H,83,84)

Cluster

Phytochemical cluster No. 51
KCF-S cluster No. 4

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN C072362

Species

Summary

Plant class

class name count
asterids 1

Family

family name count
Loganiaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Strychnos spinosa 99302 Loganiaceae asterids Viridiplantae