PCIDB

KNApSAcK Metabolite C00043545

Metabolite

KNApSAcK Entry

id C00043545
Name Glanduloside D
CAS RN 745031-69-0
Standard InChI InChI=1S/C77H120O40/c1-27-40(84)57(107-30(4)80)53(97)68(104-27)111-55-29(3)106-69(60(50(55)94)115-66-49(93)45(89)54(28(2)105-66)110-65-52(96)56(35(83)25-103-65)112-63-46(90)41(85)33(81)23-101-63)117-71(100)77-19-17-72(5,6)21-32(77)31-11-12-38-73(7)15-14-39(74(8,26-79)37(73)13-16-76(38,10)75(31,9)18-20-77)109-70-61(116-67-48(92)44(88)43(87)36(22-78)108-67)58(51(95)59(114-70)62(98)99)113-64-47(91)42(86)34(82)24-102-64/h11,26-29,32-61,63-70,78,81-97H,12-25H2,1-10H3,(H,98,99)/t27-,28+,29-,32+,33-,34-,35-,36-,37-,38-,39+,40-,41+,42+,43+,44+,45+,46-,47-,48-,49-,50+,51+,52-,53-,54+,55+,56+,57+,58+,59+,60-,61-,63+,64+,65+,66+,67+,68+,69+,70?,73+,74+,75-,76-,77+/m1/s1
Standard InChI (Main Layer) InChI=1S/C77H120O40/c1-27-40(84)57(107-30(4)80)53(97)68(104-27)111-55-29(3)106-69(60(50(55)94)115-66-49(93)45(89)54(28(2)105-66)110-65-52(96)56(35(83)25-103-65)112-63-46(90)41(85)33(81)23-101-63)117-71(100)77-19-17-72(5,6)21-32(77)31-11-12-38-73(7)15-14-39(74(8,26-79)37(73)13-16-76(38,10)75(31,9)18-20-77)109-70-61(116-67-48(92)44(88)43(87)36(22-78)108-67)58(51(95)59(114-70)62(98)99)113-64-47(91)42(86)34(82)24-102-64/h11,26-29,32-61,63-70,78,81-97H,12-25H2,1-10H3,(H,98,99)

Cluster

Phytochemical cluster No. 51
KCF-S cluster No. 49

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
Caryophyllaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Acanthophyllum glandulosum 325475 Caryophyllaceae eudicotyledons Viridiplantae