PCIDB

KNApSAcK Metabolite C00007536

Metabolite

KNApSAcK Entry

id C00007536
Name Phenylacetyl-CoA / Phenylacetyl coenzyme A
CAS RN 7532-39-0
Standard InChI InChI=1S/C29H42N7O17P3S/c1-29(2,24(40)27(41)32-9-8-19(37)31-10-11-57-20(38)12-17-6-4-3-5-7-17)14-50-56(47,48)53-55(45,46)49-13-18-23(52-54(42,43)44)22(39)28(51-18)36-16-35-21-25(30)33-15-34-26(21)36/h3-7,15-16,18,22-24,28,39-40H,8-14H2,1-2H3,(H,31,37)(H,32,41)(H,45,46)(H,47,48)(H2,30,33,34)(H2,42,43,44)/t18-,22+,23?,24+,28?/m1/s1
Standard InChI (Main Layer) InChI=1S/C29H42N7O17P3S/c1-29(2,24(40)27(41)32-9-8-19(37)31-10-11-57-20(38)12-17-6-4-3-5-7-17)14-50-56(47,48)53-55(45,46)49-13-18-23(52-54(42,43)44)22(39)28(51-18)36-16-35-21-25(30)33-15-34-26(21)36/h3-7,15-16,18,22-24,28,39-40H,8-14H2,1-2H3,(H,31,37)(H,32,41)(H,45,46)(H,47,48)(H2,30,33,34)(H2,42,43,44)

Cluster

Phytochemical cluster No. 6
KCF-S cluster No. 461

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB C00582

CTD

By CAS RN C037816

Species

Summary

Plant class

class name count

Family

family name count
Pseudomonadaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Pseudomonas pseudoalcaligenes 330 Pseudomonadaceae Bacteria