PCIDB

KNApSAcK Metabolite C00045266

Metabolite

KNApSAcK Entry

id C00045266
Name Cocciferin D1
CAS RN 418770-56-6
Standard InChI InChI=1S/C75H56O48/c76-16-44(116-67(105)20-3-30(79)49(93)31(80)4-20)62(119-68(106)21-5-32(81)50(94)33(82)6-21)61(42(91)17-113-66(104)19-1-28(77)48(92)29(78)2-19)118-74(112)27-14-41(90)55(99)59(103)60(27)115-43-15-26-47(58(102)56(43)100)46-25(13-40(89)54(98)57(46)101)73(111)120-63-45(18-114-72(26)110)117-75(123-71(109)24-11-38(87)53(97)39(88)12-24)65(122-70(108)23-9-36(85)52(96)37(86)10-23)64(63)121-69(107)22-7-34(83)51(95)35(84)8-22/h1-16,42,44-45,61-65,75,77-103H,17-18H2
Standard InChI (Main Layer) InChI=1S/C75H56O48/c76-16-44(116-67(105)20-3-30(79)49(93)31(80)4-20)62(119-68(106)21-5-32(81)50(94)33(82)6-21)61(42(91)17-113-66(104)19-1-28(77)48(92)29(78)2-19)118-74(112)27-14-41(90)55(99)59(103)60(27)115-43-15-26-47(58(102)56(43)100)46-25(13-40(89)54(98)57(46)101)73(111)120-63-45(18-114-72(26)110)117-75(123-71(109)24-11-38(87)53(97)39(88)12-24)65(122-70(108)23-9-36(85)52(96)37(86)10-23)64(63)121-69(107)22-7-34(83)51(95)35(84)8-22/h1-16,42,44-45,61-65,75,77-103H,17-18H2

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
Fagaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Quercus coccifera 58335 Fagaceae rosids Viridiplantae