PCIDB

KNApSAcK Metabolite C00037963

Metabolite

KNApSAcK Entry

id C00037963
Name TR-Saponin C
CAS RN 288153-06-0
Standard InChI InChI=1S/C53H80O21/c1-12-23(3)43(64)73-40-41(74-44(65)24(4)13-2)53(22-54)27(20-48(40,6)7)26-14-15-29-49(8)18-17-31(51(10,47(66)67)30(49)16-19-50(29,9)52(26,11)38(61)39(53)69-25(5)55)70-46-35(60)36(34(59)37(72-46)42(62)63)71-45-33(58)32(57)28(56)21-68-45/h12,14,24,27-41,45-46,54,56-61H,13,15-22H2,1-11H3,(H,62,63)(H,66,67)/b23-12-/t24?,27-,28-,29+,30+,31-,32-,33+,34-,35+,36-,37-,38-,39+,40-,41-,45-,46+,49+,50+,51-,52-,53-/m0/s1
Standard InChI (Main Layer) InChI=1S/C53H80O21/c1-12-23(3)43(64)73-40-41(74-44(65)24(4)13-2)53(22-54)27(20-48(40,6)7)26-14-15-29-49(8)18-17-31(51(10,47(66)67)30(49)16-19-50(29,9)52(26,11)38(61)39(53)69-25(5)55)70-46-35(60)36(34(59)37(72-46)42(62)63)71-45-33(58)32(57)28(56)21-68-45/h12,14,24,27-41,45-46,54,56-61H,13,15-22H2,1-11H3,(H,62,63)(H,66,67)

Cluster

Phytochemical cluster No. 51
KCF-S cluster No. 1359

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 1

Family

family name count
Theaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Camellia sinensis var.assamica 4441 Theaceae asterids Viridiplantae