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N(6)-(dimethylallyl)adenosine 5'-triphosphate

PropertiesImage
MNX_IDMNXM3671 Image of MNXM3671
referencechebi:73532
formulaC15H20N5O13P3
global charge-4
mol weight571.269
InChIKeyOPLVZTYVQUWKHB-SDBHATRESA-J
InChIInChI=1S/C15H24N5O13P3/c1-8(2)3-4-16-13-10-14(18-6-17-13)20(7-19-10)15-12(22)11(21)9(31-15)5-30-35(26,27)33-36(28,29)32-34(23,24)25/h3,6-7,9,11-12,15,21-22H,4-5H2,1-2H3,(H,26,27)(H,28,29)(H,16,17,18)(H2,23,24,25)/p-4/t9-,11-,12-,15-/m1/s1
SMILESCC(C)=CCNC1=NC=NC2=C1N=CN2[C@@H]1O[C@H](COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-])[C@@H](O)[C@H]1O
MNX internals
InChI (mnx)InChI=1/C15H24N5O13P3/c1-8(2)3-4-16-13-10-14(18-6-17-13)20(7-19-10)15-12(22)11(21)9(31-15)5-30-35(26,27)33-36(28,29)32-34(23,24)25/h3,6-7,9,11-12,15,21-22H,4-5H2,1-2H3,(H,26,27)(H,28,29)(H,16,17,18)(H2,23,24,25)/t9-,11-,12-,15-/m1/s1 Image of MNXM3671
SMILES (mnx)[CH3:1][C:8]([CH3:2])=[CH:3][CH2:4][NH:16][C:13]1=[C:10]2[C:14](=[N:18][CH:6]=[N:17]1)[N:20]([C@H:15]1[C@H:12]([OH:22])[C@H:11]([OH:21])[C@@H:9]([CH2:5][O:30][P:35]([OH:26])(=[O:27])[O:33][P:36]([OH:28])(=[O:29])[O:32][P:34]([OH:23])([OH:24])=[O:25])[O:31]1)[CH:7]=[N:19]2
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)10
in models (compartimentalized) 4
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:73532
chebi:73532
OPLVZTYVQUWKHB-SDBHATRESA-J 		N(6)-(dimethylallyl)adenosine 5'-triphosphate
N(6)-(dimethylallyl)adenosine 5'-triphosphate(4-)
N(6)-isopentenyladenosine 5'-triphosphate(4-)
N-(3-methylbut-2-en-1-yl)-5'-O-({[(phosphonatooxy)phosphinato]oxy}phosphinato)adenosine
isopentenyl-ATP(4-)
isopentenyladenosine-5'-triphosphate(4-)

seed.compound:cpd15130
seedM:cpd15130
OPLVZTYVQUWKHB-SDBHATRESA-K 		Isopentenyl-ATP
Isopentenyladenosine-5'-triphosphate
N6-(Dimethylallyl)adenosine 5'-triphosphate
N6-(delta2-isopentenyl)-adenosine 5'-triphosphate
iPRTP
iPTP
isopentenyladenosine riboside-5'-triphosphate
isopentenyladenosine-5'-triphosphate

kegg.compound:C16424
keggC:C16424
OPLVZTYVQUWKHB-SDBHATRESA-N 		Isopentenyladenosine-5'-triphosphate
Isopentenyl-ATP
N6-(Dimethylallyl)adenosine 5'-triphosphate
N6-Prenyladenosine 5'-triphosphate

vmhM:ipadsn5tp
vmhmetabolite:ipadsn5tp
OPLVZTYVQUWKHB-SDBHATRESA-N 		Isopentenyladenosine-5-triphosphate

CHEBI:71679
chebi:71679
OPLVZTYVQUWKHB-SDBHATRESA-N 		N(6)-(dimethylallyl)adenosine 5'-triphosphate
Isopentenyl-ATP
Isopentenyladenosine-5'-triphosphate
N(6)-(Delta(2)-isopentenyl)adenosine 5'-triphosphate
N(6)-isopentenyladenosine 5'-triphosphate
N-(3-methylbut-2-en-1-yl)adenosine 5'-(tetrahydrogen triphosphate)
isopentenyladenosine riboside-5'-triphosphate

metacyc.compound:CPD-4201
metacycM:CPD-4201
OPLVZTYVQUWKHB-SDBHATRESA-J 		N6-(Delta2-isopentenyl)-adenosine 5'-triphosphate
iPRTP
iPTP
isopentenyladenosine riboside-5'-triphosphate
isopentenyladenosine-5'-triphosphate

sabiork.compound:22755
sabiorkM:22755
OPLVZTYVQUWKHB-SDBHATRESA-K 		N6-(delta2-Isopentenyl)-adenosine 5'-triphosphate
hmdb:HMDB0304434
OPLVZTYVQUWKHB-SDBHATRESA-K 		N6-(delta2-isopentenyl)-adenosine 5'-triphosphate
(2R,3S,4R,5R)-2-({[hydroxy(phosphonatooxy)phosphoryl phosphonato]oxy}methyl)-5-{6-[(3-methylbut-2-en-1-yl)amino]-9H-purin-9-yl}oxolane-3,4-diol
(2R,3S,4R,5R)-2-({[hydroxy(phosphonatooxy)phosphoryl phosphonato]oxy}methyl)-5-{6-[(3-methylbut-2-en-1-yl)amino]purin-9-yl}oxolane-3,4-diol
IPRTP
IPTP
Isopentenyladenosine riboside-5'-triphosphate
Isopentenyladenosine-5'-triphosphate
N6-(delta2-isopentenyl)-adenosine 5'-triphosphoric acid

keggC:M_C16424
seedM:M_cpd15130
vmhM:M_ipadsn5tp 		secondary/obsolete/fantasy identifier