PCIDB

KNApSAcK Metabolite C00033386

Metabolite

KNApSAcK Entry

id C00033386
Name Squarroside IV / (-)-Squarroside IV
CAS RN 288840-57-3
Standard InChI InChI=1S/C59H96O26/c1-24-34(63)46(83-49-43(72)40(69)36(65)28(21-61)79-49)45(74)51(77-24)84-47-38(67)30(81-48-42(71)39(68)35(64)27(20-60)78-48)23-76-52(47)82-33-12-13-56(6)31(55(33,4)5)11-14-58(8)32(56)10-9-25-26-19-54(2,3)15-17-59(26,18-16-57(25,58)7)53(75)85-50-44(73)41(70)37(66)29(22-62)80-50/h9,24,26-52,60-74H,10-23H2,1-8H3/t24-,26-,27+,28+,29+,30+,31-,32+,33-,34-,35+,36+,37+,38-,39-,40-,41-,42+,43+,44+,45+,46+,47+,48-,49-,50-,51-,52?,56-,57+,58+,59-/m0/s1
Standard InChI (Main Layer) InChI=1S/C59H96O26/c1-24-34(63)46(83-49-43(72)40(69)36(65)28(21-61)79-49)45(74)51(77-24)84-47-38(67)30(81-48-42(71)39(68)35(64)27(20-60)78-48)23-76-52(47)82-33-12-13-56(6)31(55(33,4)5)11-14-58(8)32(56)10-9-25-26-19-54(2,3)15-17-59(26,18-16-57(25,58)7)53(75)85-50-44(73)41(70)37(66)29(22-62)80-50/h9,24,26-52,60-74H,10-23H2,1-8H3

Cluster

Phytochemical cluster No. 51
KCF-S cluster No. 4

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
Ranunculaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Thalictrum squarrosum 1084697 Ranunculaceae eudicotyledons Viridiplantae