EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:233793 - (3R,7Z,10Z,13Z)-3-hydroxyhexadecatrienoyl-CoA(4−)

ChEBI IDCHEBI:233793
ChEBI Name(3R,7Z,10Z,13Z)-3-hydroxyhexadecatrienoyl-CoA(4−)
Stars
ASCII Name(3R,7Z,10Z,13Z)-3-hydroxyhexadecatrienoyl-CoA(4-)
Submitterlaimo
DownloadsMolfile
FormulaC37H56N7O18P3S
Net Charge-4
Average Mass1011.875
Monoisotopic Mass1011.26373
SMILESCC/C=C\C/C=C\C/C=C\CCC[C@@H](O)CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)([O-])[O-]
InChIInChI=1S/C37H60N7O18P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-25(45)20-28(47)66-19-18-39-27(46)16-17-40-35(50)32(49)37(2,3)22-59-65(56,57)62-64(54,55)58-21-26-31(61-63(51,52)53)30(48)36(60-26)44-24-43-29-33(38)41-23-42-34(29)44/h5-6,8-9,11-12,23-26,30-32,36,45,48-49H,4,7,10,13-22H2,1-3H3,(H,39,46)(H,40,50)(H,54,55)(H,56,57)(H2,38,41,42)(H2,51,52,53)/p-4/b6-5-,9-8-,12-11-/t25-,26-,30-,31-,32+,36-/m1/s1
InChIKeyOAXHQTAJJFLNCO-JDKFEZBWSA-J
ChEBI Ontology
Outgoing Relation(s)
(3R,7Z,10Z,13Z)-3-hydroxyhexadecatrienoyl-CoA(4−) (CHEBI:233793) is a long-chain (R)-3-hydroxyacyl-CoA(4−) (CHEBI:229602)
Synonym  Source
CoA 3R-OH-16:3(7Z,10Z,13Z)(4−)SUBMITTER
UniProt Name  Source
(3R)-hydroxy-(7Z,10Z,13Z)-hexadecatrienoyl-CoAUniProt