PCIDB

KNApSAcK Metabolite C00048511

Metabolite

KNApSAcK Entry

id C00048511
Name Physenoside S6 / (+)-Physenoside S6
CAS RN 1191300-14-7
Standard InChI InChI=1S/C78H128O33/c1-39-60(107-66-57(93)52(88)45(85)34-101-66)55(91)59(95)67(104-39)109-62-61(108-70-63(96)78(98,37-81)38-103-70)47(105-50(86)20-16-12-8-10-14-18-40(82)19-15-11-9-13-17-29-99-65-56(92)51(87)44(84)33-100-65)35-102-69(62)111-71(97)77-27-25-72(2,3)30-42(77)41-21-22-49-73(4)31-43(83)64(110-68-58(94)54(90)53(89)46(32-79)106-68)74(5,36-80)48(73)23-24-76(49,7)75(41,6)26-28-77/h21,39,42-49,51-70,79-81,83-85,87-96,98H,8-20,22-38H2,1-7H3/t39-,42-,43-,44+,45+,46+,47-,48+,49+,51-,52-,53+,54-,55-,56+,57+,58+,59+,60-,61-,62+,63-,64-,65+,66-,67-,68-,69-,70-,73-,74-,75+,76+,77-,78+/m0/s1
Standard InChI (Main Layer) InChI=1S/C78H128O33/c1-39-60(107-66-57(93)52(88)45(85)34-101-66)55(91)59(95)67(104-39)109-62-61(108-70-63(96)78(98,37-81)38-103-70)47(105-50(86)20-16-12-8-10-14-18-40(82)19-15-11-9-13-17-29-99-65-56(92)51(87)44(84)33-100-65)35-102-69(62)111-71(97)77-27-25-72(2,3)30-42(77)41-21-22-49-73(4)31-43(83)64(110-68-58(94)54(90)53(89)46(32-79)106-68)74(5,36-80)48(73)23-24-76(49,7)75(41,6)26-28-77/h21,39,42-49,51-70,79-81,83-85,87-96,98H,8-20,22-38H2,1-7H3

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
Physenaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Physena sessiliflora 63762 Physenaceae eudicotyledons Viridiplantae