Translations:Flavin adenine dinucleotide/1/en: Difference between revisions

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Message definition (Flavin adenine dinucleotide)
{{short description|Redox-active coenzyme}}
{{Chembox
| Verifiedfields = changed
| verifiedrevid = 477393105
| ImageFile = FAD.png
| ImageFile_Ref = {{chemboximage|correct|??}}
| ImageSize = 150
| ImageName = Stereo, Kekulé, skeletal formula of FAD
| ImageFile2 = FAD_Raswin.png
| ImageFile2_Ref = {{chemboximage|correct|??}}
| ImageSize2 = 244
| ImageName2 = Spacefill model of FAD
|Section1={{Chembox Identifiers
| IUPHAR_ligand = 5184
| CASNo = 146-14-5
| CASNo_Ref = {{cascite|correct|CAS}}
| PubChem = 643975
| ChemSpiderID = 
| ChemSpiderID_Ref = 
| UNII = ZC44YTI8KK
| UNII_Ref = {{fdacite|correct|FDA}}
| EINECS = 205-663-1
| DrugBank = DB03147
| DrugBank_Ref = {{drugbankcite|correct|drugbank}}
| KEGG = C00016
| KEGG_Ref = {{keggcite|changed|kegg}}
| MeSHName = Flavin-Adenine+Dinucleotide
| ChEBI = 16238
| ChEBI_Ref = {{ebicite|correct|EBI}}
| ChEMBL = 1232653
| ChEMBL_Ref = {{ebicite|changed|EBI}}
| Beilstein = 1208946
| Gmelin = 108834
| 3DMet =  B04792
| SMILES = c12cc(C)c(C)cc1N=C3C(=O)NC(=O)N=C3N2C[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@@H](O)[C@@H](O)[C@@H](O4)n5cnc6c5ncnc6N
| SMILES_Comment = [[quinone]] form
| SMILES1 = c12cc(C)c(C)cc1N[C]3C(=O)NC(=O)N=C3N2C[C@H](O)[C@H](O)[C@H](O)COP(=O)([O-])OP(=O)([O-])OC[C@@H]4[C@@H](O)[C@@H](O)[C@@H](O4)n5cnc6c5ncnc6N
| SMILES1_Comment = [[semiquinone]] form
| SMILES2 = c12cc(C)c(C)cc1NC=3C(=O)NC(=O)NC=3N2C[C@H](O)[C@H](O)[C@H](O)COP(=O)([O-])OP(=O)([O-])OC[C@@H]4[C@@H](O)[C@@H](O)[C@@H](O4)n5cnc6c5ncnc6N
| SMILES2_Comment = [[hydroquinone]] form
| SMILES3 = c12cc(C)c(C)cc1[N+]([O-])=C3C(=O)NC(=O)N=C3N2C[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@@H](O)[C@@H](O)[C@@H](O4)n5cnc6c5ncnc6N
| SMILES3_Comment = [[Amine oxide|flavin-N(5)-oxide]] form
| InChI_Ref = {{stdinchicite|correct|PubChem}}
| InChI = 1S/C27H33N9O15P2/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/h3-4,8-9,14-16,19-21,26,37-41H,5-7H2,1-2H3,(H,44,45)(H,46,47)(H2,28,29,30)(H,34,42,43)/t14-,15+,16+,19-,20+,21+,26+/m0/s1
| InChIKey = VWWQXMAJTJZDQX-UYBVJOGSSA-N
| InChIKey_Ref = {{stdinchicite|correct|PubChem}}
}}
|Section2={{Chembox Properties
| C=27 | H=33 | P=2 | N=9 | O=15 
| Appearance = White, vitreous crystals
| LogP = -1.336
| pKa = 1.128
| pKb = 12.8689
}}
}}
Flavin adenine dinucleotide/1/en
Stereo, Kekulé, skeletal formula of FAD
Spacefill model of FAD
Identifiers
3D model (JSmol)
3DMet
1208946
ChEBI
ChEMBL
DrugBank
EC Number
  • 205-663-1
108834
KEGG
MeSH Flavin-Adenine+Dinucleotide
UNII
Properties
C27H33N9O15P2
Molar mass 785.557 g·mol−1
Appearance White, vitreous crystals
log P -1.336
Acidity (pKa) 1.128
Basicity (pKb) 12.8689
Tracking categories (test):
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