PCIDB

KNApSAcK Metabolite C00034163

Metabolite

KNApSAcK Entry

id C00034163
Name Polygalasaponin L / (+)-Polygalasaponin L
CAS RN 1033593-10-0
Standard InChI InChI=1S/C64H100O34/c1-23-33(70)39(76)46(96-52-44(81)40(77)45(24(2)91-52)95-50-41(78)36(73)31(19-87-50)94-55-48(82)64(86,22-89-55)21-88-51-42(79)37(74)34(71)29(17-65)92-51)54(90-23)98-57(85)62-11-10-58(3,4)15-26(62)25-14-27(68)47-59(5)16-28(69)49(97-53-43(80)38(75)35(72)30(18-66)93-53)61(7,56(83)84)32(59)8-9-60(47,6)63(25,20-67)13-12-62/h14,23-24,26,28-55,65-67,69-82,86H,8-13,15-22H2,1-7H3,(H,83,84)/t23-,24+,26+,28+,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+,59+,60-,61+,62+,63+,64-/m1/s1
Standard InChI (Main Layer) InChI=1S/C64H100O34/c1-23-33(70)39(76)46(96-52-44(81)40(77)45(24(2)91-52)95-50-41(78)36(73)31(19-87-50)94-55-48(82)64(86,22-89-55)21-88-51-42(79)37(74)34(71)29(17-65)92-51)54(90-23)98-57(85)62-11-10-58(3,4)15-26(62)25-14-27(68)47-59(5)16-28(69)49(97-53-43(80)38(75)35(72)30(18-66)93-53)61(7,56(83)84)32(59)8-9-60(47,6)63(25,20-67)13-12-62/h14,23-24,26,28-55,65-67,69-82,86H,8-13,15-22H2,1-7H3,(H,83,84)

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
rosids 1

Family

family name count
Polygalaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Polygala japonica 690795 Polygalaceae rosids Viridiplantae