PCIDB

KNApSAcK Metabolite C00045398

Metabolite

KNApSAcK Entry

id C00045398
Name Saprosmoside D / (-)-Saprosmoside D
CAS RN 438239-74-8
Standard InChI InChI=1S/C36H44O22S2/c1-59-35(47)51-7-11-3-15(39)21-13(9-49-31(19(11)21)57-33-26(43)25(42)23(40)17(5-37)54-33)30(46)56-28-24(41)18(6-38)55-34(27(28)44)58-32-20-12(8-52-36(48)60-2)4-16-22(20)14(10-50-32)29(45)53-16/h3-4,9-10,15-28,31-34,37-44H,5-8H2,1-2H3/t15-,16-,17+,18+,19+,20+,21-,22-,23+,24+,25-,26+,27+,28?,31-,32-,33-,34-/m0/s1
Standard InChI (Main Layer) InChI=1S/C36H44O22S2/c1-59-35(47)51-7-11-3-15(39)21-13(9-49-31(19(11)21)57-33-26(43)25(42)23(40)17(5-37)54-33)30(46)56-28-24(41)18(6-38)55-34(27(28)44)58-32-20-12(8-52-36(48)60-2)4-16-22(20)14(10-50-32)29(45)53-16/h3-4,9-10,15-28,31-34,37-44H,5-8H2,1-2H3

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