PCIDB

KNApSAcK Metabolite C00032582

Metabolite

KNApSAcK Entry

id C00032582
Name 1,3,6-Trihydroxy-2-hydroxymethyl-9,10-anthraquinone 3-O-beta-primeveroside
CAS RN 470704-09-7
Standard InChI InChI=1S/C26H28O15/c27-5-12-14(4-11-16(19(12)32)18(31)9-2-1-8(28)3-10(9)17(11)30)40-26-24(37)22(35)21(34)15(41-26)7-39-25-23(36)20(33)13(29)6-38-25/h1-4,13,15,20-29,32-37H,5-7H2/t13-,15-,20+,21-,22+,23-,24-,25?,26-/m1/s1
Standard InChI (Main Layer) InChI=1S/C26H28O15/c27-5-12-14(4-11-16(19(12)32)18(31)9-2-1-8(28)3-10(9)17(11)30)40-26-24(37)22(35)21(34)15(41-26)7-39-25-23(36)20(33)13(29)6-38-25/h1-4,13,15,20-29,32-37H,5-7H2

Cluster

Phytochemical cluster No. 62
KCF-S cluster No. 1320

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