PCIDB

KNApSAcK Metabolite C00044492

Metabolite

KNApSAcK Entry

id C00044492
Name Acetylgaertneroside / (+)-Acetylgaertneroside
CAS RN 497178-34-4
Standard InChI InChI=1S/C28H30O14/c1-12(29)38-11-18-21(32)22(33)23(34)27(40-18)41-26-19-15(17(10-39-26)24(35)37-2)7-8-28(19)9-16(25(36)42-28)20(31)13-3-5-14(30)6-4-13/h3-10,15,18-23,26-27,30-34H,11H2,1-2H3/t15-,18-,19-,20?,21-,22+,23-,26-,27+,28-/m1/s1
Standard InChI (Main Layer) InChI=1S/C28H30O14/c1-12(29)38-11-18-21(32)22(33)23(34)27(40-18)41-26-19-15(17(10-39-26)24(35)37-2)7-8-28(19)9-16(25(36)42-28)20(31)13-3-5-14(30)6-4-13/h3-10,15,18-23,26-27,30-34H,11H2,1-2H3

Cluster

Phytochemical cluster
KCF-S cluster No. 774

Link

ChEMBL

By standard InChI CHEMBL464502
By standard InChI Main Layer CHEMBL464502 CHEMBL1077224

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
Morinda morindoides 659048 Rubiaceae asterids Viridiplantae