PCIDB

KNApSAcK Metabolite C00045396

Metabolite

KNApSAcK Entry

id C00045396
Name Saprosmoside B / (-)-Saprosmoside B
CAS RN 438239-45-3
Standard InChI InChI=1S/C34H44O22S/c1-57-34(48)51-7-11-3-15(39)21-13(9-50-31(19(11)21)55-32-26(44)24(42)22(40)16(5-36)52-32)29(47)54-27-25(43)23(41)17(6-37)53-33(27)56-30-18-10(4-35)2-14(38)20(18)12(8-49-30)28(45)46/h2-3,8-9,14-27,30-33,35-44H,4-7H2,1H3,(H,45,46)/t14-,15-,16+,17+,18+,19+,20-,21-,22+,23+,24-,25-,26+,27?,30-,31-,32-,33-/m0/s1
Standard InChI (Main Layer) InChI=1S/C34H44O22S/c1-57-34(48)51-7-11-3-15(39)21-13(9-50-31(19(11)21)55-32-26(44)24(42)22(40)16(5-36)52-32)29(47)54-27-25(43)23(41)17(6-37)53-33(27)56-30-18-10(4-35)2-14(38)20(18)12(8-49-30)28(45)46/h2-3,8-9,14-27,30-33,35-44H,4-7H2,1H3,(H,45,46)

Cluster

Phytochemical cluster
KCF-S cluster No. 1059

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 1

Family

family name count
Rubiaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Saprosma scortechinii 358842 Rubiaceae asterids Viridiplantae