PCIDB

KNApSAcK Metabolite C00040905

Metabolite

KNApSAcK Entry

id C00040905
Name Calcicolin A
CAS RN 132185-53-6
Standard InChI InChI=1S/C28H38O10/c1-12-17-9-18(35-13(2)29)22-27(8)20(36-14(3)30)10-19(33)26(6,7)23(27)21(37-15(4)31)25(38-16(5)32)28(22,11-17)24(12)34/h17-23,25,33H,1,9-11H2,2-8H3/t17?,18-,19-,20-,21+,22-,23+,25-,27-,28-/m0/s1
Standard InChI (Main Layer) InChI=1S/C28H38O10/c1-12-17-9-18(35-13(2)29)22-27(8)20(36-14(3)30)10-19(33)26(6,7)23(27)21(37-15(4)31)25(38-16(5)32)28(22,11-17)24(12)34/h17-23,25,33H,1,9-11H2,2-8H3

Cluster

Phytochemical cluster No. 41
KCF-S cluster No. 63

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL468345

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 calcicola 662906 Lamiaceae asterids Viridiplantae