PCIDB

KNApSAcK Metabolite C00033172

Metabolite

KNApSAcK Entry

id C00033172
Name Marstomentoside J / (+)-Marstomentoside J
CAS RN 238398-87-3
Standard InChI InChI=1S/C55H88O23/c1-13-25(2)48(62)72-29(6)53(63)18-19-55(65)52(53,9)37(73-30(7)57)23-36-51(8)16-15-32(20-31(51)14-17-54(36,55)64)74-38-21-33(66-10)44(26(3)69-38)76-39-22-34(67-11)45(27(4)70-39)77-50-43(61)47(68-12)46(28(5)71-50)78-49-42(60)41(59)40(58)35(24-56)75-49/h13-14,26-29,32-47,49-50,56,58-61,63-65H,15-24H2,1-12H3/b25-13+/t26-,27-,28-,29+,32+,33+,34+,35-,36-,37-,38+,39+,40-,41+,42-,43-,44-,45-,46-,47-,49+,50+,51+,52-,53-,54+,55-/m1/s1
Standard InChI (Main Layer) InChI=1S/C55H88O23/c1-13-25(2)48(62)72-29(6)53(63)18-19-55(65)52(53,9)37(73-30(7)57)23-36-51(8)16-15-32(20-31(51)14-17-54(36,55)64)74-38-21-33(66-10)44(26(3)69-38)76-39-22-34(67-11)45(27(4)70-39)77-50-43(61)47(68-12)46(28(5)71-50)78-49-42(60)41(59)40(58)35(24-56)75-49/h13-14,26-29,32-47,49-50,56,58-61,63-65H,15-24H2,1-12H3

Cluster

Phytochemical cluster
KCF-S cluster No. 192

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
Apocynaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Marsdenia tomentosa 276779 Apocynaceae asterids Viridiplantae