PCIDB

KNApSAcK Metabolite C00038255

Metabolite

KNApSAcK Entry

id C00038255
Name 3-Epiocotillol / 3-epi-Ocotillol
CAS RN 35761-53-6
Standard InChI InChI=1S/C30H52O3/c1-25(2)21-12-17-29(7)22(27(21,5)15-13-23(25)31)10-9-19-20(11-16-28(19,29)6)30(8)18-14-24(33-30)26(3,4)32/h19-24,31-32H,9-18H2,1-8H3/t19-,20+,21+,22-,23-,24-,27+,28-,29-,30+/m1/s1
Standard InChI (Main Layer) InChI=1S/C30H52O3/c1-25(2)21-12-17-29(7)22(27(21,5)15-13-23(25)31)10-9-19-20(11-16-28(19,29)6)30(8)18-14-24(33-30)26(3,4)32/h19-24,31-32H,9-18H2,1-8H3

Cluster

Phytochemical cluster No. 51
KCF-S cluster No. 23

Link

ChEMBL

By standard InChI CHEMBL375698
By standard InChI Main Layer CHEMBL375698 CHEMBL523757

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 2

Family

family name count
Meliaceae 2

List (3)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Aglaia foveolata 201006 Meliaceae rosids Viridiplantae
Aglaia tomentosa 306518 Meliaceae rosids Viridiplantae
Cabralea polytricha