PCIDB

KNApSAcK Metabolite C00032135

Metabolite

KNApSAcK Entry

id C00032135
Name Sinocrassoside B4 / (-)-Sinocrassoside B4
CAS RN 909803-30-1
Standard InChI InChI=1S/C38H48O22/c1-4-12(2)35(52)58-34-32(59-36-29(50)27(48)24(45)20(10-39)56-36)23(44)13(3)53-38(34)54-15-8-18(43)22-19(9-15)55-31(14-5-6-16(41)17(42)7-14)33(26(22)47)60-37-30(51)28(49)25(46)21(11-40)57-37/h5-9,12-13,20-21,23-25,27-30,32,34,36-46,48-51H,4,10-11H2,1-3H3/t12-,13-,20+,21+,23-,24+,25+,27-,28-,29+,30+,32+,34+,36-,37-,38-/m0/s1
Standard InChI (Main Layer) InChI=1S/C38H48O22/c1-4-12(2)35(52)58-34-32(59-36-29(50)27(48)24(45)20(10-39)56-36)23(44)13(3)53-38(34)54-15-8-18(43)22-19(9-15)55-31(14-5-6-16(41)17(42)7-14)33(26(22)47)60-37-30(51)28(49)25(46)21(11-40)57-37/h5-9,12-13,20-21,23-25,27-30,32,34,36-46,48-51H,4,10-11H2,1-3H3

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