PCIDB

KNApSAcK Metabolite C00049606

Metabolite

KNApSAcK Entry

id C00049606
Name 3alpha-Hydroxy-13(18)-oleanene-27,28-dioic acid
CAS RN 239789-92-5
Standard InChI InChI=1S/C30H46O5/c1-25(2)13-14-29(23(32)33)15-16-30(24(34)35)18(19(29)17-25)7-8-21-27(5)11-10-22(31)26(3,4)20(27)9-12-28(21,30)6/h20-22,31H,7-17H2,1-6H3,(H,32,33)(H,34,35)/t20-,21+,22+,27-,28+,29-,30+/m0/s1
Standard InChI (Main Layer) InChI=1S/C30H46O5/c1-25(2)13-14-29(23(32)33)15-16-30(24(34)35)18(19(29)17-25)7-8-21-27(5)11-10-22(31)26(3,4)20(27)9-12-28(21,30)6/h20-22,31H,7-17H2,1-6H3,(H,32,33)(H,34,35)

Cluster

Phytochemical cluster No. 51
KCF-S cluster No. 13

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
Myrtaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Melaleuca leucadendron 164925 Myrtaceae rosids Viridiplantae