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coenzyme F390-A

PropertiesImage
MNX_IDMNXM1364102 Image of MNXM1364102
referencechebi:62784
formulaC39H48N10O24P2
global charge0
mol weight1102.807
InChIKeyWYXLWMBDMKFRML-CSDPJWOXSA-N
InChIInChI=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
SMILESC[C@H](OP(=O)(O)OC[C@@H](O)[C@@H](O)[C@@H](O)CN1C2=CC(OP(=O)(O)OC[C@H]3O[C@@H](N4C=NC5=C4N=CN=C5N)[C@H](O)[C@@H]3O)=CC=C2C=C2C(=O)NC(=O)N=C21)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O
MNX internals
InChI (mnx)InChI=1/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 Image of MNXM1364102
SMILES (mnx)[CH3:1][C@@H:15]([C:34](=[N:45][C@@H:20]([CH2:4][CH2:6][C:25](=[N:44][C@@H:19]([CH2:5][CH2:7][C:26](=[O:53])[OH:54])[C:37](=[O:60])[OH:61])[OH:52])[C:38](=[O:62])[OH:63])[OH:58])[O:72][P:74]([OH:65])(=[O:66])[O:69][CH2:11][C@H:23]([C@H:28]([C@H:22]([CH2:10][N:48]1[C:21]2=[C:16]([CH:2]=[CH:3][C:17]([O:73][P:75]([OH:67])(=[O:68])[O:70][CH2:12][C@@H:24]3[C@@H:29]([OH:56])[C@@H:30]([OH:57])[C@H:36]([N:49]4[CH:14]=[N:43][C:27]5=[C:31]([NH2:40])[N:41]=[CH:13][N:42]=[C:33]54)[O:71]3)=[CH:9]2)[CH:8]=[C:18]2[C:32]1=[N:46][C:39](=[O:64])[N:47]=[C:35]2[OH:59])[OH:50])[OH:55])[OH:51]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:62784
chebi:62784
WYXLWMBDMKFRML-CSDPJWOXSA-N 		coenzyme F390-A
(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
8-hydroxyadenylylated-coenzyme F420
F390-A
Factor 390 A
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)-gamma-L-glutamyl]-L-glutamic acid

seed.compound:cpd22531
seedM:cpd22531
WYXLWMBDMKFRML-CSDPJWOXSA-I 		F390-A
P-5-(S)-N-(N-(1-Oxo-2-(phosphonooxy)propyl)-L-gamma-glutamyl)-L-glutamate
P-5-(S)-N-(N-(1-Oxo-2-(phosphooxy)propyl)-gamma-L-glutamyl)-L-glutamate
coenzyme F390-A
factor 390 A

seedM:M_cpd22531 		secondary/obsolete/fantasy identifier