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p-Coumaroyl-diketide-CoA

PropertiesImageOccurences in reactions
MNX_IDMNXM734952Image of MNXM734952
#reac
in my sandbox 0
in MNXref (generic)6
in models (compartimentalized) 0
formulaC32H44N7O19P3S
charge0
mass955.16255
referencekeggC:C17740
InChIKeyFZWJGTSJBJBNKS-VVHSVQLPSA-N
InChIInChI=1S/C32H44N7O19P3S/c1-32(2,27(45)30(46)35-10-9-22(42)34-11-12-62-23(43)13-20(41)8-5-18-3-6-19(40)7-4-18)15-55-61(52,53)58-60(50,51)54-14-21-26(57-59(47,48)49)25(44)31(56-21)39-17-38-24-28(33)36-16-37-29(24)39/h3-8,16-17,21,25-27,31,40,44-45H,9-15H2,1-2H3,(H,34,42)(H,35,46)(H,50,51)(H,52,53)(H2,33,36,37)(H2,47,48,49)/b8-5+/t21-,25-,26-,27+,31-/m1/s1
SMILESCC(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)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)CC(=O)/C=C/c1ccc(O)cc1
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
kegg.compound:C17740
keggC:C17740 		p-Coumaroyl-diketide-CoA
(4-Coumaroyl)acetyl-CoA
CHEBI:71211
chebi:71211 		(4-coumaroyl)acetyl-CoA
(4-coumaroyl)acetyl-CoA(4-)
(4-coumaroyl)acetyl-coenzyme A(4-)
3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[5-(4-hydroxyphenyl)-3-oxopent-4-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] diphosphate}
p-coumaroyldiketide-CoA
p-coumaroyldiketide-coenzyme A
CHEBI:71215
chebi:71215 		(4-coumaroyl)acetyl-CoA
(4-coumaroyl)acetyl-coenzyme A
(p-coumaroyl)acetyl-CoA
(p-coumaroyl)acetyl-coenzyme A
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[5-(4-hydroxyphenyl)-3-oxopent-4-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
4-coumaroyldiketide-CoA
4-coumaroyldiketide-coenzyme A
p-Coumaroyl-diketide-CoA
p-coumaroyldiketide-CoA
p-coumaroyldiketide-coenzyme A
metacyc.compound:CPD-12184
metacycM:CPD-12184 		4-coumaroylacetyl-CoA
4-coumaroyl-diketide-CoA
4-coumaroyl-diketide-coenzyme A
p-coumaroyl-diketide-CoA
p-coumaroyl-diketide-coenzyme A
seed.compound:cpd17837
seedM:cpd17837 		p-Coumaroyl-diketide-CoA
(4-Coumaroyl)acetyl-CoA
4-coumaroyl-diketide-CoA
4-coumaroyl-diketide-coenzyme A
4-coumaroylacetyl-CoA
p-coumaroyl-diketide-CoA
p-coumaroyl-diketide-coenzyme A
p-coumaroyldiketide-CoA
p-coumaroyldiketide-coenzyme A
keggC:M_C17740
seedM:M_cpd17837 		secondary/obsolete/fantasy identifier