CHEBI:62784 - coenzyme F390-A

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ChEBI Name coenzyme F390-A
ChEBI ID CHEBI:62784
ChEBI ASCII Name coenzyme F390-A
Definition 8-OH adenylated form of the deazaflavin coenzyme F420.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Endang Purwantini
Supplier Information No supplier information found for this compound.
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Formula C39H48N10O24P2
Net Charge 0
Average Mass 1102.79850
Monoisotopic Mass 1102.23182
InChI InChI=1S/C39H48N10O24P2/c1-15(34(58)45-20(38(62)63)4-6-25(52)44-19(37(60)61)5-7-26(53)54)72-74(65,66)69-11-23(51)28(55)22(50)10-48-21-9-17(3-2-16(21)8-18-32(48)46-39(64)47-35(18)59)73-75(67,68)70-12-24-29(56)30(57)36(71-24)49-14-43-27-31(40)41-13-42-33(27)49/h2-3,8-9,13-15,19-20,22-24,28-30,36,50-51,55-57H,4-7,10-12H2,1H3,(H,44,52)(H,45,58)(H,53,54)(H,60,61)(H,62,63)(H,65,66)(H,67,68)(H2,40,41,42)(H,47,59,64)/t15-,19-,20-,22-,23+,24+,28-,29+,30+,36+/m0/s1
InChIKey WYXLWMBDMKFRML-CSDPJWOXSA-N
SMILES C[C@H](OP(O)(=O)OC[C@@H](O)[C@@H](O)[C@@H](O)Cn1c2cc(OP(O)(=O)OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c(N)ncnc34)ccc2cc2c1nc(=O)[nH]c2=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(O)=O)C(O)=O)C(O)=O
Roles Classification
Biological Role(s): coenzyme
A low-molecular-weight, non-protein organic compound participating in enzymatic reactions as dissociable acceptor or donor of chemical groups or electrons.
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ChEBI Ontology
Outgoing coenzyme F390-A (CHEBI:62784) has functional parent 7,8-didemethyl-8-hydroxy-5-deazariboflavin (CHEBI:43034)
coenzyme F390-A (CHEBI:62784) has functional parent adenosine 5'-monophosphate (CHEBI:16027)
coenzyme F390-A (CHEBI:62784) has role coenzyme (CHEBI:23354)
coenzyme F390-A (CHEBI:62784) is a pyrimidoquinolines (CHEBI:59535)
coenzyme F390-A (CHEBI:62784) is a ribitol phosphate (CHEBI:26554)
IUPAC Name
(3S,8S,11S,16R,17S,18S)-19-[8-{[{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methoxy}(hydroxy)phosphoryl]oxy}-2,4-dioxo-3,4-dihydropyrimido[4,5-b]quinolin-10(2H)-yl]-13,16,17,18-tetrahydroxy-11-methyl-5,10-dioxo-12,14-dioxa-4,9-diaza-13-phosphanonadecane-1,3,8-tricarboxylic acid 13-oxide
Synonyms Sources
8-hydroxyadenylylated-coenzyme F420 SUBMITTER
F390-A ChemIDplus
F390-A ChEBI
Factor 390 A ChemIDplus
N-[N-(O-{1-[8-[5'-adenylyloxy]-2,4-dioxo-2,3,4,10-tetrahydropyrimido[4,5-b]quinolin-10-yl]-1-deoxy-D-ribityl-5-phospho}-(S)-lactyl)-γ-L-glutamyl]-L-glutamic acid ChEBI
Manual Xref Database
CPD-10017 MetaCyc
View more database links
Registry Number Type Source
95617-07-5 CAS Registry Number ChemIDplus
Citations Waiting for Citations
Last Modified
23 August 2011