PCIDB

KNApSAcK Metabolite C00048477

Metabolite

KNApSAcK Entry

id C00048477
Name Maoecrystal A
CAS RN 96850-30-5
Standard InChI InChI=1S/C22H28O6/c1-10-12-5-6-13-21(8-12,19(10)28-11(2)23)18(26)16(25)17-20(3,4)15-7-14(24)22(13,17)9-27-15/h12-13,15-17,19,25H,1,5-9H2,2-4H3/t12?,13-,15-,16+,17-,19-,21-,22-/m1/s1
Standard InChI (Main Layer) InChI=1S/C22H28O6/c1-10-12-5-6-13-21(8-12,19(10)28-11(2)23)18(26)16(25)17-20(3,4)15-7-14(24)22(13,17)9-27-15/h12-13,15-17,19,25H,1,5-9H2,2-4H3

Cluster

Phytochemical cluster
KCF-S cluster No. 4098

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL465509

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 sinuolata 204130 Lamiaceae asterids Viridiplantae