PCIDB

KNApSAcK Metabolite C00037828

Metabolite

KNApSAcK Entry

id C00037828
Name Smiglaside A
CAS RN 288254-95-5
Standard InChI InChI=1S/C48H52O23/c1-25(49)63-23-38-44(66-26(2)50)43(59)45(67-27(3)51)47(68-38)71-48(24-65-40(56)17-11-29-8-14-32(53)35(20-29)61-5)46(69-41(57)18-12-30-9-15-33(54)36(21-30)62-6)42(58)37(70-48)22-64-39(55)16-10-28-7-13-31(52)34(19-28)60-4/h7-21,37-38,42-47,52-54,58-59H,22-24H2,1-6H3/b16-10+,17-11+,18-12+/t37-,38-,42-,43+,44-,45-,46+,47-,48+/m1/s1
Standard InChI (Main Layer) InChI=1S/C48H52O23/c1-25(49)63-23-38-44(66-26(2)50)43(59)45(67-27(3)51)47(68-38)71-48(24-65-40(56)17-11-29-8-14-32(53)35(20-29)61-5)46(69-41(57)18-12-30-9-15-33(54)36(21-30)62-6)42(58)37(70-48)22-64-39(55)16-10-28-7-13-31(52)34(19-28)60-4/h7-21,37-38,42-47,52-54,58-59H,22-24H2,1-6H3

Cluster

Phytochemical cluster
KCF-S cluster No. 334

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
Liliopsida 1

Family

family name count
Smilacaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Smilax glabra 703614 Smilacaceae Liliopsida Viridiplantae