CHEBI:142390 - trans-6-hydroxyferuloyl-CoA(4−)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name trans-6-hydroxyferuloyl-CoA(4−)
ChEBI ID CHEBI:142390
ChEBI ASCII Name trans-6-hydroxyferuloyl-CoA(4-)
Stars This entity has been manually annotated by a third party.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C31H40N7O20P3S
Net Charge -4
Average Mass 955.670
Monoisotopic Mass 955.12836
InChI InChI=1S/C31H44N7O20P3S/c1-31(2,26(44)29(45)34-7-6-21(41)33-8-9-62-22(42)5-4-16-10-19(53-3)18(40)11-17(16)39)13-55-61(51,52)58-60(49,50)54-12-20-25(57-59(46,47)48)24(43)30(56-20)38-15-37-23-27(32)35-14-36-28(23)38/h4-5,10-11,14-15,20,24-26,30,39-40,43-44H,6-9,12-13H2,1-3H3,(H,33,41)(H,34,45)(H,49,50)(H,51,52)(H2,32,35,36)(H2,46,47,48)/p-4/b5-4+/t20-,24-,25-,26?,30-/m1/s1
InChIKey NWKKCROQKYNXQZ-GLMZNTAHSA-J
SMILES [C@@H]1(N2C3=C(C(=NC=N3)N)N=C2)O[C@H](COP(OP(OCC(C(C(NCCC(NCCSC(=O)/C=C/C4=C(C=C(C(=C4)OC)O)O)=O)=O)O)(C)C)(=O)[O-])(=O)[O-])[C@H]([C@H]1O)OP([O-])([O-])=O
ChEBI Ontology
Outgoing trans-6-hydroxyferuloyl-CoA(4−) (CHEBI:142390) has functional parent trans-feruloyl-CoA(4−) (CHEBI:87305)
trans-6-hydroxyferuloyl-CoA(4−) (CHEBI:142390) is a acyl-CoA(4−) (CHEBI:58342)
Synonym Source
(E)-6-hydroxyferuloyl-CoA UniProt
Citations Waiting for Citations Types Sources
18547395 PubMed citation SUBMITTER
25993561 PubMed citation SUBMITTER