PCIDB

KNApSAcK Metabolite C00048493

Metabolite

KNApSAcK Entry

id C00048493
Name Nilotinin D2
CAS RN 1194825-85-8
Standard InChI InChI=1S/C68H50O44/c69-12-35(57(109-60(95)15-1-23(70)41(81)24(71)2-15)56-33(80)13-103-63(98)18-7-28(75)44(84)49(89)37(18)39-20(65(100)108-56)9-30(77)46(86)51(39)91)106-67(102)22-11-32(79)48(88)53(93)55(22)105-34-6-17(5-27(74)43(34)83)62(97)112-68-54(94)59(111-61(96)16-3-25(72)42(82)26(73)4-16)58-36(107-68)14-104-64(99)19-8-29(76)45(85)50(90)38(19)40-21(66(101)110-58)10-31(78)47(87)52(40)92/h1-12,33,35-36,54,56-59,68,70-94H,13-14H2
Standard InChI (Main Layer) InChI=1S/C68H50O44/c69-12-35(57(109-60(95)15-1-23(70)41(81)24(71)2-15)56-33(80)13-103-63(98)18-7-28(75)44(84)49(89)37(18)39-20(65(100)108-56)9-30(77)46(86)51(39)91)106-67(102)22-11-32(79)48(88)53(93)55(22)105-34-6-17(5-27(74)43(34)83)62(97)112-68-54(94)59(111-61(96)16-3-25(72)42(82)26(73)4-16)58-36(107-68)14-104-64(99)19-8-29(76)45(85)50(90)38(19)40-21(66(101)110-58)10-31(78)47(87)52(40)92/h1-12,33,35-36,54,56-59,68,70-94H,13-14H2

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
eudicotyledons 1

Family

family name count
Tamaricaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Tamarix nilotica 189799 Tamaricaceae eudicotyledons Viridiplantae