PCIDB

KNApSAcK Metabolite C00041319

Metabolite

KNApSAcK Entry

id C00041319
Name Adociasulfate 2
CAS RN 208181-29-7
Standard InChI InChI=1S/C36H54O9S2/c1-31(2)15-8-16-36(7)25(31)11-18-34(5)27-12-17-33(4)26(32(27,3)20-14-29(34)43-36)13-19-35(6)28(33)21-22-23(44-46(37,38)39)9-10-24(30(22)35)45-47(40,41)42/h9-10,25-29H,8,11-21H2,1-7H3,(H,37,38,39)(H,40,41,42)/t25-,26+,27+,28-,29-,32+,33+,34-,35-,36-/m0/s1
Standard InChI (Main Layer) InChI=1S/C36H54O9S2/c1-31(2)15-8-16-36(7)25(31)11-18-34(5)27-12-17-33(4)26(32(27,3)20-14-29(34)43-36)13-19-35(6)28(33)21-22-23(44-46(37,38)39)9-10-24(30(22)35)45-47(40,41)42/h9-10,25-29H,8,11-21H2,1-7H3,(H,37,38,39)(H,40,41,42)

Cluster

Phytochemical cluster
KCF-S cluster No. 1175

Link

ChEMBL

By standard InChI CHEMBL1207665
By standard InChI Main Layer CHEMBL1207665

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count

Family

family name count
Chalinidae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Haliclona sp. 34490 Chalinidae Metazoa