PCIDB

KNApSAcK Metabolite C00002382

Metabolite

KNApSAcK Entry

id C00002382
Name Isobutrin
CAS RN 536-01-6
Standard InChI InChI=1S/C27H32O15/c28-9-18-20(33)22(35)24(37)26(41-18)39-12-3-4-13(16(32)8-12)14(30)5-1-11-2-6-15(31)17(7-11)40-27-25(38)23(36)21(34)19(10-29)42-27/h1-8,18-29,31-38H,9-10H2/b5-1+/t18?,19?,20-,21-,22+,23?,24?,25?,26-,27-/m1/s1
Standard InChI (Main Layer) InChI=1S/C27H32O15/c28-9-18-20(33)22(35)24(37)26(41-18)39-12-3-4-13(16(32)8-12)14(30)5-1-11-2-6-15(31)17(7-11)40-27-25(38)23(36)21(34)19(10-29)42-27/h1-8,18-29,31-38H,9-10H2

Cluster

Phytochemical cluster No. 13
KCF-S cluster No. 169

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB C08649

CTD

By CAS RN C049385

Species

Summary

Plant class

class name count
rosids 2

Family

family name count
Fabaceae 2

List (2)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Butea frondosa 56060 Fabaceae rosids Viridiplantae
Butea monosperma 56060 Fabaceae rosids Viridiplantae