PCIDB

KNApSAcK Metabolite C00035068

Metabolite

KNApSAcK Entry

id C00035068
Name Caryocaroside III-23 / (+)-Caryocaroside III-23
CAS RN 914257-95-7
Standard InChI InChI=1S/C54H86O25/c1-21-29(59)32(62)34(64)44(72-21)75-39-31(61)26(19-56)74-46(37(39)67)76-40-36(66)41(43(69)70)77-47(38(40)68)78-42-24(58)17-50(4)27(51(42,5)20-57)10-11-53(7)28(50)9-8-22-23-16-49(2,3)12-14-54(23,15-13-52(22,53)6)48(71)79-45-35(65)33(63)30(60)25(18-55)73-45/h8,21,23-42,44-47,55-68H,9-20H2,1-7H3,(H,69,70)/t21-,23-,24-,25+,26+,27+,28+,29-,30+,31-,32+,33-,34+,35+,36-,37+,38+,39-,40-,41-,42-,44-,45-,46-,47-,50-,51-,52+,53+,54+/m0/s1
Standard InChI (Main Layer) InChI=1S/C54H86O25/c1-21-29(59)32(62)34(64)44(72-21)75-39-31(61)26(19-56)74-46(37(39)67)76-40-36(66)41(43(69)70)77-47(38(40)68)78-42-24(58)17-50(4)27(51(42,5)20-57)10-11-53(7)28(50)9-8-22-23-16-49(2,3)12-14-54(23,15-13-52(22,53)6)48(71)79-45-35(65)33(63)30(60)25(18-55)73-45/h8,21,23-42,44-47,55-68H,9-20H2,1-7H3,(H,69,70)

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
rosids 1

Family

family name count
Caryocaraceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Caryocar villosum 507520 Caryocaraceae rosids Viridiplantae