PCIDB

KNApSAcK Metabolite C00039734

Metabolite

KNApSAcK Entry

id C00039734
Name Maoecrystal I
CAS RN 121817-30-9
Standard InChI InChI=1S/C22H30O8/c1-10-12-4-5-13-20-9-30-22(28,21(13,7-12)17(10)26)18(27)16(20)19(3,8-29-11(2)23)14(24)6-15(20)25/h12-16,18,24-25,27-28H,1,4-9H2,2-3H3/t12-,13+,14+,15-,16-,18+,19-,20-,21+,22-/m1/s1
Standard InChI (Main Layer) InChI=1S/C22H30O8/c1-10-12-4-5-13-20-9-30-22(28,21(13,7-12)17(10)26)18(27)16(20)19(3,8-29-11(2)23)14(24)6-15(20)25/h12-16,18,24-25,27-28H,1,4-9H2,2-3H3

Cluster

Phytochemical cluster
KCF-S cluster No. 83

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL253333

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 1

Family

family name count
Lamiaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Isodon xerophilus 662931 Lamiaceae asterids Viridiplantae