PCIDB

KNApSAcK Metabolite C00042343

Metabolite

KNApSAcK Entry

id C00042343
Name Caseargrewiin B / (+)-Caseargrewiin B
CAS RN 847841-93-4
Standard InChI InChI=1S/C37H46O11/c1-8-10-30(41)46-27-19-28-34(44-23(5)38)48-35(45-24(6)39)37(28)29(20-27)36(7,18-17-21(3)9-2)22(4)32(33(37)43)47-31(42)16-13-25-11-14-26(40)15-12-25/h9,11-16,19,22,27,29,32-35,40,43H,2-3,8,10,17-18,20H2,1,4-7H3/b16-13+/t22-,27+,29+,32-,33+,34+,35-,36-,37?/m1/s1
Standard InChI (Main Layer) InChI=1S/C37H46O11/c1-8-10-30(41)46-27-19-28-34(44-23(5)38)48-35(45-24(6)39)37(28)29(20-27)36(7,18-17-21(3)9-2)22(4)32(33(37)43)47-31(42)16-13-25-11-14-26(40)15-12-25/h9,11-16,19,22,27,29,32-35,40,43H,2-3,8,10,17-18,20H2,1,4-7H3

Cluster

Phytochemical cluster
KCF-S cluster No. 895

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 1

Family

family name count
Salicaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Casearia grewiifolia 112816 Salicaceae rosids Viridiplantae