PCIDB

KNApSAcK Metabolite C00047090

Metabolite

KNApSAcK Entry

id C00047090
Name Rubupungenoside B
CAS RN 264617-27-8
Standard InChI InChI=1S/C73H112O24/c1-34-17-23-71(60(88)96-56-49(82)48(81)46(79)40(31-74)93-56)27-26-65(6)37(52(71)69(34,10)90)14-16-43-63(4)30-39(78)55(73(33-76,58(85)86)45(63)20-22-67(43,65)8)95-59(87)68(9)44-19-21-66(7)42(62(44,3)29-38(77)54(68)84)15-13-36-53-70(11,91)35(2)18-24-72(53,28-25-64(36,66)5)61(89)97-57-50(83)51(92-12)47(80)41(32-75)94-57/h13-14,34-35,38-57,74-84,90-91H,15-33H2,1-12H3,(H,85,86)/t34-,35-,38-,39-,40-,41-,42-,43-,44-,45-,46-,47-,48+,49-,50-,51+,52-,53-,54+,55-,56+,57+,62-,63-,64-,65-,66-,67-,68+,69-,70-,71+,72+,73-/m1/s1
Standard InChI (Main Layer) InChI=1S/C73H112O24/c1-34-17-23-71(60(88)96-56-49(82)48(81)46(79)40(31-74)93-56)27-26-65(6)37(52(71)69(34,10)90)14-16-43-63(4)30-39(78)55(73(33-76,58(85)86)45(63)20-22-67(43,65)8)95-59(87)68(9)44-19-21-66(7)42(62(44,3)29-38(77)54(68)84)15-13-36-53-70(11,91)35(2)18-24-72(53,28-25-64(36,66)5)61(89)97-57-50(83)51(92-12)47(80)41(32-75)94-57/h13-14,34-35,38-57,74-84,90-91H,15-33H2,1-12H3,(H,85,86)

Cluster

Phytochemical cluster
KCF-S cluster No. 5465

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
Rosaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Rubus pungens 321608 Rosaceae rosids Viridiplantae