PCIDB

KNApSAcK Metabolite C00040172

Metabolite

KNApSAcK Entry

id C00040172
Name Rubicunoside C / (-)-Rubicunoside C
CAS RN 180965-44-0
Standard InChI InChI=1S/C72H112O38/c1-25-51(104-59-44(86)38(80)30(77)22-96-59)42(84)47(89)61(98-25)105-52-26(2)99-64(56(49(52)91)108-63-48(90)43(85)53(100-27(3)76)33(21-74)102-63)110-66(95)72-17-16-67(4,5)18-29(72)28-10-11-35-68(6)14-13-37(69(7,24-75)34(68)12-15-70(35,8)71(28,9)19-36(72)79)103-65-57(109-62-46(88)41(83)40(82)32(20-73)101-62)54(50(92)55(107-65)58(93)94)106-60-45(87)39(81)31(78)23-97-60/h10,24-26,29-57,59-65,73-74,77-92H,11-23H2,1-9H3,(H,93,94)/t25-,26+,29-,30+,31+,32+,33+,34+,35+,36+,37-,38-,39-,40-,41-,42-,43+,44+,45+,46+,47+,48-,49-,50-,51-,52-,53+,54-,55-,56+,57+,59-,60-,61-,62-,63-,64-,65+,68-,69-,70+,71+,72+/m0/s1
Standard InChI (Main Layer) InChI=1S/C72H112O38/c1-25-51(104-59-44(86)38(80)30(77)22-96-59)42(84)47(89)61(98-25)105-52-26(2)99-64(56(49(52)91)108-63-48(90)43(85)53(100-27(3)76)33(21-74)102-63)110-66(95)72-17-16-67(4,5)18-29(72)28-10-11-35-68(6)14-13-37(69(7,24-75)34(68)12-15-70(35,8)71(28,9)19-36(72)79)103-65-57(109-62-46(88)41(83)40(82)32(20-73)101-62)54(50(92)55(107-65)58(93)94)106-60-45(87)39(81)31(78)23-97-60/h10,24-26,29-57,59-65,73-74,77-92H,11-23H2,1-9H3,(H,93,94)

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
Caryophyllaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Silene rubicunda 3573 Caryophyllaceae eudicotyledons Viridiplantae