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1,4-dihydroxy-2-naphthoyl-CoA

Properties
MNX_IDMNXM2306
formulaC32H38N7O19P3S
charge-4
mass949.667183
referencechebi:58897
Image of MNXM2306
InChIKeyPYTINLGPKDJURZ-HSJNEKGZSA-J
InChIInChI=1S/C32H42N7O19P3S/c1-32(2,26(44)29(45)35-8-7-21(41)34-9-10-62-31(46)18-11-19(40)16-5-3-4-6-17(16)23(18)42)13-55-61(52,53)58-60(50,51)54-12-20-25(57-59(47,48)49)24(43)30(56-20)39-15-38-22-27(33)36-14-37-28(22)39/h3-6,11,14-15,20,24-26,30,40,42-44H,7-10,12-13H2,1-2H3,(H,34,41)(H,35,45)(H,50,51)(H,52,53)(H2,33,36,37)(H2,47,48,49)/p-4/t20-,24-,25-,26+,30-/m1/s1
SMILESCC(C)(COP([O-])(=O)OP([O-])(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP([O-])([O-])=O)n1cnc2c(N)ncnc12)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)c1cc(O)c2ccccc2c1O

Occurences in reactions

#reac
Distinct reactions in my sandbox 0
Distinct generic reactions in MNXref4
Distinct compatimentalized reactions in models3

Similar chemical compounds in external resources
IdentifierDescription
keggC:C15547 1,4-Dihydroxy-2-naphthoyl-CoA
chebi:52668 1,4-dihydroxy-2-naphthoyl-CoA
1,4-Dihydroxy-2-naphthoyl-CoA
1,4-dihydroxy-2-naphthoyl-coenzyme A
3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(1,4-dihydroxy-2-naphthoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
DHNA-CoA
biggM:M_14dhncoa
keggC:M_C15547
seedM:M_cpd11217
secondary/obsolete/fantasy identifier
metacycM:CPD-9925 1,4-dihydroxy-2-naphthoyl-CoA
1,4-dihydroxy-2-naphthoate-CoA
DHNA-CoA
chebi:58897 1,4-dihydroxy-2-naphthoyl-CoA
1,4-dihydroxy-2-naphthoyl-CoA tetraanion
1,4-dihydroxy-2-naphthoyl-CoA(4-)
1,4-dihydroxy-2-naphthoyl-coenzyme A(4-)
3'-phosphonatoadenosine 5'-{3-[(3R)-4-{[3-({2-[(1,4-dihydroxy-2-naphthoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl]diphosphate}
biggM:14dhncoa 1,4-dihydroxy-2-napthoyl-CoA
seedM:cpd11217 1,4-Dihydroxy-2-naphthoyl-CoA
1,4-dihydroxy-2-naphthoate-CoA
1,4-dihydroxy-2-naphthoyl-CoA
DHNA-CoA
MNXM147663is deprecated and replaced by this entry
MNXM91812is deprecated and replaced by this entry