PCIDB

KNApSAcK Metabolite C00032136

Metabolite

KNApSAcK Entry

id C00032136
Name Sinocrassoside B5 / (-)-Sinocrassoside B5
CAS RN 909803-31-2
Standard InChI InChI=1S/C42H54O24/c1-5-14(2)39(57)64-37-35(65-41-33(55)31(53)28(50)24(63-41)13-58-38(56)15(3)11-43)26(48)16(4)59-42(37)60-18-9-21(47)25-22(10-18)61-34(17-6-7-19(45)20(46)8-17)36(29(25)51)66-40-32(54)30(52)27(49)23(12-44)62-40/h6-10,14-16,23-24,26-28,30-33,35,37,40-50,52-55H,5,11-13H2,1-4H3/t14-,15?,16-,23+,24+,26-,27+,28+,30-,31-,32+,33+,35+,37+,40-,41-,42-/m0/s1
Standard InChI (Main Layer) InChI=1S/C42H54O24/c1-5-14(2)39(57)64-37-35(65-41-33(55)31(53)28(50)24(63-41)13-58-38(56)15(3)11-43)26(48)16(4)59-42(37)60-18-9-21(47)25-22(10-18)61-34(17-6-7-19(45)20(46)8-17)36(29(25)51)66-40-32(54)30(52)27(49)23(12-44)62-40/h6-10,14-16,23-24,26-28,30-33,35,37,40-50,52-55H,5,11-13H2,1-4H3

Cluster

Phytochemical cluster No. 15
KCF-S cluster No. 5

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
eudicotyledons 1

Family

family name count
Crassulaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Sinocrassula indica 91157 Crassulaceae eudicotyledons Viridiplantae