PCIDB

KNApSAcK Metabolite C00040953

Metabolite

KNApSAcK Entry

id C00040953
Name Euphorbin A
CAS RN 180308-72-9
Standard InChI InChI=1S/C82H58O53/c83-27-1-18(2-28(84)50(27)97)69(109)122-16-43-64(128-70(110)19-3-29(85)51(98)30(86)4-19)67(131-71(111)20-5-31(87)52(99)32(88)6-20)68(80(127-43)134-73(113)22-9-35(91)54(101)36(92)10-22)132-77(117)26-12-38(94)56(103)61(108)62(26)124-41-13-24-46(60(107)58(41)105)45-23(11-37(93)55(102)59(45)106)75(115)130-66-48-78(118)125-40-15-39(95)57(104)65-47(40)49-25(14-44(96)82(121,135-65)81(49,119)120)76(116)129-63(66)42(17-123-74(24)114)126-79(48)133-72(112)21-7-33(89)53(100)34(90)8-21/h1-15,42-43,48-49,63-64,66-68,79-80,83-95,97-108,119-121H,16-17H2
Standard InChI (Main Layer) InChI=1S/C82H58O53/c83-27-1-18(2-28(84)50(27)97)69(109)122-16-43-64(128-70(110)19-3-29(85)51(98)30(86)4-19)67(131-71(111)20-5-31(87)52(99)32(88)6-20)68(80(127-43)134-73(113)22-9-35(91)54(101)36(92)10-22)132-77(117)26-12-38(94)56(103)61(108)62(26)124-41-13-24-46(60(107)58(41)105)45-23(11-37(93)55(102)59(45)106)75(115)130-66-48-78(118)125-40-15-39(95)57(104)65-47(40)49-25(14-44(96)82(121,135-65)81(49,119)120)76(116)129-63(66)42(17-123-74(24)114)126-79(48)133-72(112)21-7-33(89)53(100)34(90)8-21/h1-15,42-43,48-49,63-64,66-68,79-80,83-95,97-108,119-121H,16-17H2

Cluster

Phytochemical cluster No. 81
KCF-S cluster No. 126

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
Euphorbiaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Acalypha hispida 197604 Euphorbiaceae rosids Viridiplantae