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FADH2

PropertiesImage
MNX_IDMNXM1105762 Image of MNXM1105762
referencechebi:58307
formulaC27H33N9O15P2
global charge-2
mol weight785.557
InChIKeyYPZRHBJKEMOYQH-UYBVJOGSSA-L
InChIInChI=1S/C27H35N9O15P2/c1-10-3-12-13(4-11(10)2)35(24-18(32-12)25(42)34-27(43)33-24)5-14(37)19(39)15(38)6-48-52(44,45)51-53(46,47)49-7-16-20(40)21(41)26(50-16)36-9-31-17-22(28)29-8-30-23(17)36/h3-4,8-9,14-16,19-21,26,32,37-41H,5-7H2,1-2H3,(H,44,45)(H,46,47)(H2,28,29,30)(H2,33,34,42,43)/p-2/t14-,15+,16+,19-,20+,21+,26+/m0/s1
SMILESCC1=CC2=C(C=C1C)N(C[C@H](O)[C@H](O)[C@H](O)COP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@@H](N3C=NC4=C3N=CN=C4N)[C@H](O)[C@@H]1O)C1=C(N2)C(=O)NC(=O)N1
MNX internals
InChI (mnx)InChI=1/C27H35N9O15P2/c1-10-3-12-13(4-11(10)2)35(24-18(32-12)25(42)34-27(43)33-24)5-14(37)19(39)15(38)6-48-52(44,45)51-53(46,47)49-7-16-20(40)21(41)26(50-16)36-9-31-17-22(28)29-8-30-23(17)36/h3-4,8-9,14-16,19-21,26,32,37-41H,5-7H2,1-2H3,(H,44,45)(H,46,47)(H2,28,29,30)(H2,33,34,42,43)/t14-,15+,16+,19-,20+,21+,26+/m0/s1 Image of MNXM1105762
SMILES (mnx)[CH3:1][C:10]1=[CH:3][C:12]2=[C:13]([CH:4]=[C:11]1[CH3:2])[N:35]([CH2:5][C@@H:14]([C@@H:19]([C@@H:15]([CH2:6][O:48][P:52]([OH:44])(=[O:45])[O:51][P:53]([OH:46])(=[O:47])[O:49][CH2:7][C@@H:16]1[C@@H:20]([OH:40])[C@@H:21]([OH:41])[C@H:26]([N:36]3[CH:9]=[N:31][C:17]4=[C:22]([NH2:28])[N:29]=[CH:8][N:30]=[C:23]43)[O:50]1)[OH:38])[OH:39])[OH:37])[C:24]1=[C:18]([C:25]([OH:42])=[N:34][C:27]([OH:43])=[N:33]1)[NH:32]2
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)772
in models (compartimentalized) 420
Similar chemical compounds in external resources
IdentifierDescription

reactome:R-ALL-164934
reactomeM:R-ALL-164934
reactome:R-ALL-31649
reactomeM:R-ALL-31649
CHEBI:58307
chebi:58307
YPZRHBJKEMOYQH-UYBVJOGSSA-L 		FADH2
(2R,3S,4S)-5-{7,8-dimethyl-2,4-dioxo-1H,2H,3H,4H,5H,10H-benzo[g]pteridin-10-yl}-2,3,4-trihydroxypentyl ({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphonato}oxy)phosphonate
1,5-dihydro-FAD dianion
1,5-dihydro-FAD(2-)
FADH2 dianion
FADH2(2-)
adenosine 5'-(3-{D-ribo-5-[7,8-dimethyl-2,4-dioxo-1,3,4,5-tetrahydrobenzo[g]pteridin-10(2H)-yl]-2,3,4-trihydroxypentyl} diphosphate)
dihydroflavin adenine dinucleotide dianion
dihydroflavin adenine dinucleotide(2-)

sabiork.compound:2274
sabiorkM:2274
kegg.compound:C01352
keggC:C01352
YPZRHBJKEMOYQH-UYBVJOGSSA-N 		FADH2

CHEBI:17877
chebi:17877
YPZRHBJKEMOYQH-UYBVJOGSSA-N 		FADH2
1,5-dihydro-FAD
DIHYDROFLAVINE-ADENINE DINUCLEOTIDE
adenosine 5'-(3-{D-ribo-5-[7,8-dimethyl-2,4-dioxo-1,3,4,5-tetrahydrobenzo[g]pteridin-10(2H)-yl]-2,3,4-trihydroxypentyl} dihydrogen diphosphate)
flavin adenine dinucleotide (reduced)

seed.compound:cpd00982
seedM:cpd00982
YPZRHBJKEMOYQH-UYBVJOGSSA-L 		FADH2
1,5-dihydro-FAD
Flavin adenine dinucleotide reduced
Flavinadeninedinucleotidereduced
fadh2
flavin adenine dinucleotide reduced

metacyc.compound:FADH2
metacycM:FADH2
YPZRHBJKEMOYQH-UYBVJOGSSA-L 		FADH2
1,5-dihydro-FAD
flavin adenine dinucleotide reduced
hmdb:HMDB0001197
YPZRHBJKEMOYQH-UYBVJOGSSA-N 		FADH
1,5-Dihydro-fad
1,5-Dihydro-p-5-ester with adenosine
1,5-Dihydro-riboflavin 5'-(trihydrogen diphosphate) p'->5'-ester with adenosine
Adenosine 5'-(trihydrogen pyrophosphate), 5'-5'-ester with 5,10-dihydro-7,8-dimethyl-10-(D-ribo-2,3,4,5-tetrahydroxypentyl)alloxazine
Adenosine 5'-(trihydrogen pyrophosphate), 5'->5'-ester with 5,10-dihydro-7,8-dimethyl-10-(D-ribo-2,3,4,5-tetrahydroxypentyl)alloxazine
Adenosine 5'-{3-[D-ribo-5-(7,8-dimethyl-2,4-dioxo-1,2,3,4,5,10-tetrahydrobenzo[g]pteridin-10-yl)-2,3,4-trihydroxypentyl] dihydrogen diphosphate}
Adenosine 5-(trihydrogen pyrophosphate)
Adenosine pyrophosphate 5'-5'-ester with 5,10-dihydro-7,8-dimethyl-10-(D-ribo-2,3,4,5-tetrahydroxypentyl)alloxazine
Adenosine pyrophosphate, 5'-5'-ester with 5,10-dihydro-7,8-dimethyl-10-(D-ribo-2,3,4,5-tetrahydroxypentyl)alloxazine
Adenosine pyrophosphate, 5'->5'-ester with 5,10-dihydro-7,8-dimethyl-10-(D-ribo-2,3,4,5-tetrahydroxypentyl)alloxazine
Benzo[GR]pteridine riboflavin 5'-(trihydrogen diphosphate) deriv
Benzo[g]pteridine riboflavin 5'-(trihydrogen diphosphate) deriv
DIHYDROFLAVINE-adenine dinucleotide
Dihydro-fad
FADH2
FDA
Flavin adenine dinucleotide (reduced)
Flavin adenine dinucleotide reduced
Reduced flavine adenine dinucleotide
fadh(.)
{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}[({[(2R,3S,4S)-5-{7,8-dimethyl-2,4-dioxo-1H,2H,3H,4H,5H,10H-benzo[g]pteridin-10-yl}-2,3,4-trihydroxypentyl]oxy}(hydroxy)phosphoryl)oxy]phosphinic acid

bigg.metabolite:fadh2
biggM:fadh2
YPZRHBJKEMOYQH-UYBVJOGSSA-L 		Flavin adenine dinucleotide reduced

vmhM:fadh2
vmhmetabolite:fadh2
YPZRHBJKEMOYQH-UYBVJOGSSA-L 		Flavin adenine dinucleotide reduced
{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}[({[(2R,3S,4S)-5-{7,8-dimethyl-2,4-dioxo-1H,2H,3H,4H,5H,10H-benzo[g]pteridin-10-yl}-2,3,4-trihydroxypentyl]

metacyc.compound:Red-FADH2-Flavoproteins
metacycM:Red-FADH2-Flavoproteins
YPZRHBJKEMOYQH-UYBVJOGSSA-L 		a reduced flavoprotein (FADH2)

hmdb:HMDB0006252
hmdb:HMDB0006358
hmdb:HMDB01197
hmdb:HMDB06252
hmdb:HMDB06358
chebi:13316
chebi:21126
chebi:42427
chebi:4957
biggM:M_fadh2
keggC:M_C01352
seedM:M_cpd00982
vmhM:M_fadh2 		secondary/obsolete/fantasy identifier