PCIDB

KNApSAcK Metabolite C00034829

Metabolite

KNApSAcK Entry

id C00034829
Name Craigoside A
CAS RN 879561-99-6
Standard InChI InChI=1S/C61H86O34/c1-8-26-29(33(53(78)81-5)21-86-56(26)93-59-50(75)47(72)44(69)37(16-63)90-59)12-40(66)84-19-25(15-62)43-32(20-85-41(67)13-30-27(9-2)57(87-22-34(30)54(79)82-6)94-60-51(76)48(73)45(70)38(17-64)91-60)24(4)11-36(43)89-42(68)14-31-28(10-3)58(88-23-35(31)55(80)83-7)95-61-52(77)49(74)46(71)39(18-65)92-61/h8-10,21-25,29-32,36-39,43-52,56-65,69-77H,11-20H2,1-7H3/b26-8+,27-9+,28-10+/t24-,25-,29-,30?,31-,32+,36-,37+,38+,39+,43-,44+,45+,46+,47-,48-,49-,50+,51+,52+,56-,57-,58?,59-,60-,61-/m0/s1
Standard InChI (Main Layer) InChI=1S/C61H86O34/c1-8-26-29(33(53(78)81-5)21-86-56(26)93-59-50(75)47(72)44(69)37(16-63)90-59)12-40(66)84-19-25(15-62)43-32(20-85-41(67)13-30-27(9-2)57(87-22-34(30)54(79)82-6)94-60-51(76)48(73)45(70)38(17-64)91-60)24(4)11-36(43)89-42(68)14-31-28(10-3)58(88-23-35(31)55(80)83-7)95-61-52(77)49(74)46(71)39(18-65)92-61/h8-10,21-25,29-32,36-39,43-52,56-65,69-77H,11-20H2,1-7H3

Cluster

Phytochemical cluster
KCF-S cluster No. 2713

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 1

Family

family name count
Oleaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Jasminum abyssinicum 210360 Oleaceae asterids Viridiplantae