PCIDB

KNApSAcK Metabolite C00003636

Metabolite

KNApSAcK Entry

id C00003636
Name Scillaren A
CAS RN 124-99-2
Standard InChI InChI=1S/C36H52O13/c1-17-31(49-33-29(42)27(40)26(39)24(15-37)48-33)28(41)30(43)32(46-17)47-20-8-11-34(2)19(14-20)5-6-23-22(34)9-12-35(3)21(10-13-36(23,35)44)18-4-7-25(38)45-16-18/h4,7,14,16-17,20-24,26-33,37,39-44H,5-6,8-13,15H2,1-3H3/t17?,20-,21+,22-,23+,24?,26+,27-,28+,29?,30?,31-,32-,33-,34-,35+,36-/m0/s1
Standard InChI (Main Layer) InChI=1S/C36H52O13/c1-17-31(49-33-29(42)27(40)26(39)24(15-37)48-33)28(41)30(43)32(46-17)47-20-8-11-34(2)19(14-20)5-6-23-22(34)9-12-35(3)21(10-13-36(23,35)44)18-4-7-25(38)45-16-18/h4,7,14,16-17,20-24,26-33,37,39-44H,5-6,8-13,15H2,1-3H3

Cluster

Phytochemical cluster No. 57
KCF-S cluster No. 3132

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL1697772

KEGG

By LinkDB C08879

CTD

By CAS RN C022878

Species

Summary

Plant class

class name count
Liliopsida 1

Family

family name count
Hyacinthaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Urginea maritima 82070 Hyacinthaceae Liliopsida Viridiplantae