PCIDB

KNApSAcK Metabolite C00047089

Metabolite

KNApSAcK Entry

id C00047089
Name Rubupungenoside A
CAS RN 264617-26-7
Standard InChI InChI=1S/C73H112O24/c1-34-17-23-71(60(88)96-56-50(82)48(80)46(78)40(31-74)93-56)28-26-65(6)37(53(71)70(34,11)91)14-16-43-63(4)30-39(77)55(73(33-75,58(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(76)54(68)84)15-13-36-52-69(10,90)35(2)18-24-72(52,27-25-64(36,66)5)61(89)97-57-51(83)49(81)47(79)41(94-57)32-92-12/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)96-56-50(82)48(80)46(78)40(31-74)93-56)28-26-65(6)37(53(71)70(34,11)91)14-16-43-63(4)30-39(77)55(73(33-75,58(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(76)54(68)84)15-13-36-52-69(10,90)35(2)18-24-72(52,27-25-64(36,66)5)61(89)97-57-51(83)49(81)47(79)41(94-57)32-92-12/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