PCIDB

KNApSAcK Metabolite C00048492

Metabolite

KNApSAcK Entry

id C00048492
Name Nilotinin D1
CAS RN 1194825-47-2
Standard InChI InChI=1S/C75H54O48/c76-25-1-16(2-26(77)44(25)88)65(103)119-62-58(102)74(115-38-14-112-69(107)20-9-32(83)48(92)53(97)40(20)42-22(71(109)117-60(38)62)11-34(85)50(94)55(42)99)122-68(106)19-7-31(82)47(91)37(8-19)114-59-24(13-36(87)52(96)57(59)101)73(111)121-64-63(120-66(104)17-3-27(78)45(89)28(79)4-17)61-39(116-75(64)123-67(105)18-5-29(80)46(90)30(81)6-18)15-113-70(108)21-10-33(84)49(93)54(98)41(21)43-23(72(110)118-61)12-35(86)51(95)56(43)100/h1-13,38-39,58,60-64,74-102H,14-15H2
Standard InChI (Main Layer) InChI=1S/C75H54O48/c76-25-1-16(2-26(77)44(25)88)65(103)119-62-58(102)74(115-38-14-112-69(107)20-9-32(83)48(92)53(97)40(20)42-22(71(109)117-60(38)62)11-34(85)50(94)55(42)99)122-68(106)19-7-31(82)47(91)37(8-19)114-59-24(13-36(87)52(96)57(59)101)73(111)121-64-63(120-66(104)17-3-27(78)45(89)28(79)4-17)61-39(116-75(64)123-67(105)18-5-29(80)46(90)30(81)6-18)15-113-70(108)21-10-33(84)49(93)54(98)41(21)43-23(72(110)118-61)12-35(86)51(95)56(43)100/h1-13,38-39,58,60-64,74-102H,14-15H2

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