PCIDB

KNApSAcK Metabolite C00014800

Metabolite

KNApSAcK Entry

id C00014800
Name Delphinidin 3-(6-p-coumaroylglucoside)-5-[6-(malonyl)-4-(rhamnosyl)glucoside)]
CAS RN 444587-00-2
Standard InChI InChI=1S/C45H48O26/c1-16-32(54)35(57)38(60)43(65-16)71-42-28(15-64-31(53)13-29(50)51)70-45(40(62)37(42)59)67-25-11-20(47)10-24-21(25)12-26(41(66-24)18-8-22(48)33(55)23(49)9-18)68-44-39(61)36(58)34(56)27(69-44)14-63-30(52)7-4-17-2-5-19(46)6-3-17/h2-12,16,27-28,32,34-40,42-45,54,56-62H,13-15H2,1H3,(H5-,46,47,48,49,50,51,52,55)/p+1/t16?,27?,28?,32-,34+,35?,36-,37+,38-,39?,40?,42+,43-,44+,45+/m0/s1
Standard InChI (Main Layer) InChI=1S/C45H48O26/c1-16-32(54)35(57)38(60)43(65-16)71-42-28(15-64-31(53)13-29(50)51)70-45(40(62)37(42)59)67-25-11-20(47)10-24-21(25)12-26(41(66-24)18-8-22(48)33(55)23(49)9-18)68-44-39(61)36(58)34(56)27(69-44)14-63-30(52)7-4-17-2-5-19(46)6-3-17/h2-12,16,27-28,32,34-40,42-45,54,56-62H,13-15H2,1H3,(H5-,46,47,48,49,50,51,52,55)

Cluster

Phytochemical cluster No. 15
KCF-S cluster No. 7

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

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
Muscari armeniacum 156613 Hyacinthaceae Liliopsida Viridiplantae