PCIDB

KNApSAcK Metabolite C00035224

Metabolite

KNApSAcK Entry

id C00035224
Name 3-O-Acetylanthothecanolide / (-)-3-O-Acetylanthothecanolide
CAS RN 861660-02-8
Standard InChI InChI=1S/C28H34O11/c1-14(29)37-21-22(2,3)17-9-18(30)36-13-24(17)16-5-7-23(4)20(15-6-8-35-11-15)38-19(31)10-27(23,33)26(16)12-25(21,32)28(24,34)39-26/h6,8,11,16-17,20-21,32-34H,5,7,9-10,12-13H2,1-4H3/t16-,17+,20+,21?,23+,24-,25?,26-,27+,28?/m1/s1
Standard InChI (Main Layer) InChI=1S/C28H34O11/c1-14(29)37-21-22(2,3)17-9-18(30)36-13-24(17)16-5-7-23(4)20(15-6-8-35-11-15)38-19(31)10-27(23,33)26(16)12-25(21,32)28(24,34)39-26/h6,8,11,16-17,20-21,32-34H,5,7,9-10,12-13H2,1-4H3

Cluster

Phytochemical cluster
KCF-S cluster No. 255

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
Meliaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Khaya anthotheca 124953 Meliaceae rosids Viridiplantae