PCIDB

KNApSAcK Metabolite C00029176

Metabolite

KNApSAcK Entry

id C00029176
Name Vanilloylzygadenine / 3-Vanilloylzygadenine
CAS RN 67370-01-8
Standard InChI InChI=1S/C35H49NO10/c1-17-5-10-25-32(3,41)27-19(16-36(25)15-17)20-14-33-24(34(20,42)29(39)28(27)38)9-8-23-31(33,2)12-11-26(35(23,43)46-33)45-30(40)18-6-7-21(37)22(13-18)44-4/h6-7,13,17,19-20,23-29,37-39,41-43H,5,8-12,14-16H2,1-4H3/t17-,19+,20-,23?,24+,25-,26-,27+,28+,29-,31-,32+,33+,34-,35?/m0/s1
Standard InChI (Main Layer) InChI=1S/C35H49NO10/c1-17-5-10-25-32(3,41)27-19(16-36(25)15-17)20-14-33-24(34(20,42)29(39)28(27)38)9-8-23-31(33,2)12-11-26(35(23,43)46-33)45-30(40)18-6-7-21(37)22(13-18)44-4/h6-7,13,17,19-20,23-29,37-39,41-43H,5,8-12,14-16H2,1-4H3

Cluster

Phytochemical cluster No. 11
KCF-S cluster No. 321

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
Liliopsida 1

Family

family name count
Melanthiaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Veratrum oblongum LOES.f. 50241 Melanthiaceae Liliopsida Viridiplantae