PCIDB

KNApSAcK Metabolite C00033163

Metabolite

KNApSAcK Entry

id C00033163
Name Marstomentoside A / (+)-Marstomentoside A
CAS RN 238398-33-9
Standard InChI InChI=1S/C71H103NO24/c1-37-58(74)64(84-13)59(75)66(89-37)96-63-41(5)88-57(34-50(63)83-12)95-62-40(4)87-56(33-49(62)82-11)94-61-39(3)86-55(32-48(61)81-10)93-60-38(2)85-54(31-47(60)80-9)91-46-24-25-67(7)45(30-46)23-26-70(78)51(67)35-52(92-53(73)22-21-43-18-15-14-16-19-43)68(8)69(77,27-28-71(68,70)79)42(6)90-65(76)44-20-17-29-72-36-44/h14-23,29,36-42,46-52,54-64,66,74-75,77-79H,24-28,30-35H2,1-13H3/b22-21+/t37-,38-,39-,40-,41-,42+,46+,47+,48+,49-,50-,51-,52-,54+,55+,56+,57+,58-,59-,60-,61-,62-,63-,64+,66+,67+,68-,69-,70+,71-/m1/s1
Standard InChI (Main Layer) InChI=1S/C71H103NO24/c1-37-58(74)64(84-13)59(75)66(89-37)96-63-41(5)88-57(34-50(63)83-12)95-62-40(4)87-56(33-49(62)82-11)94-61-39(3)86-55(32-48(61)81-10)93-60-38(2)85-54(31-47(60)80-9)91-46-24-25-67(7)45(30-46)23-26-70(78)51(67)35-52(92-53(73)22-21-43-18-15-14-16-19-43)68(8)69(77,27-28-71(68,70)79)42(6)90-65(76)44-20-17-29-72-36-44/h14-23,29,36-42,46-52,54-64,66,74-75,77-79H,24-28,30-35H2,1-13H3

Cluster

Phytochemical cluster
KCF-S cluster No. 269

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