PCIDB

KNApSAcK Metabolite C00029498

Metabolite

KNApSAcK Entry

id C00029498
Name 3'-Hydroxy rocagloic acid
CAS RN 917393-85-2
Standard InChI InChI=1S/C27H26O9/c1-33-16-12-19(35-3)23-20(13-16)36-27(15-9-10-18(34-2)17(28)11-15)22(14-7-5-4-6-8-14)21(25(30)31)24(29)26(23,27)32/h4-13,21-22,24,28-29,32H,1-3H3,(H,30,31)/t21-,22-,24-,26+,27+/m1/s1
Standard InChI (Main Layer) InChI=1S/C27H26O9/c1-33-16-12-19(35-3)23-20(13-16)36-27(15-9-10-18(34-2)17(28)11-15)22(14-7-5-4-6-8-14)21(25(30)31)24(29)26(23,27)32/h4-13,21-22,24,28-29,32H,1-3H3,(H,30,31)

Cluster

Phytochemical cluster
KCF-S cluster No. 449

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 1

Family

family name count
Meliaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Amoora cucullata 43707 Meliaceae rosids Viridiplantae