PCIDB

KNApSAcK Metabolite C00042456

Metabolite

KNApSAcK Entry

id C00042456
Name Dehydroatalantin
CAS RN 55279-87-3
Standard InChI InChI=1S/C27H30O9/c1-23(2)18-17(29)19(30)25(4)15(26(18,13-34-23)10-7-16(28)32-5)6-9-24(3)20(14-8-11-33-12-14)35-22(31)21-27(24,25)36-21/h7-8,10-12,15,18,20-21H,6,9,13H2,1-5H3/b10-7-/t15-,18-,20-,21+,24-,25-,26-,27+/m0/s1
Standard InChI (Main Layer) InChI=1S/C27H30O9/c1-23(2)18-17(29)19(30)25(4)15(26(18,13-34-23)10-7-16(28)32-5)6-9-24(3)20(14-8-11-33-12-14)35-22(31)21-27(24,25)36-21/h7-8,10-12,15,18,20-21H,6,9,13H2,1-5H3

Cluster

Phytochemical cluster No. 51
KCF-S cluster No. 204

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 2

Family

family name count
Rutaceae 2

List (2)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Atalantia macrophylla 414733 Rutaceae rosids Viridiplantae
Severinia buxifolia 76974 Rutaceae rosids Viridiplantae