PCIDB

KNApSAcK Metabolite C00042840

Metabolite

KNApSAcK Entry

id C00042840
Name Pescaprein II / (-)-Pescaprein II
CAS RN 849042-42-8
Standard InChI InChI=1S/C62H108O24/c1-10-12-14-15-16-17-20-23-28-32-41(64)81-56-55(86-58-47(70)44(67)42(65)34(5)74-58)52(83-59-48(71)46(69)50(36(7)76-59)82-57(73)33(3)4)38(9)78-62(56)84-51-37(8)77-60-49(72)53(51)80-40(63)31-27-24-21-18-19-22-26-30-39(29-25-13-11-2)79-61-54(85-60)45(68)43(66)35(6)75-61/h33-39,42-56,58-62,65-72H,10-32H2,1-9H3/t34-,35+,36-,37-,38-,39-,42-,43-,44+,45-,46-,47+,48+,49?,50-,51-,52-,53-,54+,55+,56+,58-,59-,60?,61-,62-/m0/s1
Standard InChI (Main Layer) InChI=1S/C62H108O24/c1-10-12-14-15-16-17-20-23-28-32-41(64)81-56-55(86-58-47(70)44(67)42(65)34(5)74-58)52(83-59-48(71)46(69)50(36(7)76-59)82-57(73)33(3)4)38(9)78-62(56)84-51-37(8)77-60-49(72)53(51)80-40(63)31-27-24-21-18-19-22-26-30-39(29-25-13-11-2)79-61-54(85-60)45(68)43(66)35(6)75-61/h33-39,42-56,58-62,65-72H,10-32H2,1-9H3

Cluster

Phytochemical cluster
KCF-S cluster No. 87

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL509568

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 1

Family

family name count
Convolvulaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Ipomoea pes-caprae 89656 Convolvulaceae asterids Viridiplantae