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THF-L-glutamate

PropertiesImage
MNX_IDMNXM1104336 Image of MNXM1104336
referencekeggC:C09332
formulaC24H30N8O9
global charge0
mol weight574.551
InChIKeyZAOGJXDWOQXFBW-KKUMJFAQSA-N
InChIInChI=1S/C24H30N8O9/c25-24-31-19-18(21(37)32-24)28-13(10-27-19)9-26-12-3-1-11(2-4-12)20(36)30-15(23(40)41)5-7-16(33)29-14(22(38)39)6-8-17(34)35/h1-4,13-15,26,28H,5-10H2,(H,29,33)(H,30,36)(H,34,35)(H,38,39)(H,40,41)(H4,25,27,31,32,37)/t13-,14-,15-/m0/s1
SMILESNC1=NC2=C(N[C@@H](CNC3=CC=C(C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C=C3)CN2)C(=O)N1
MNX internals
InChI (mnx)InChI=1/C24H30N8O9/c25-24-31-19-18(21(37)32-24)28-13(10-27-19)9-26-12-3-1-11(2-4-12)20(36)30-15(23(40)41)5-7-16(33)29-14(22(38)39)6-8-17(34)35/h1-4,13-15,26,28H,5-10H2,(H,29,33)(H,30,36)(H,34,35)(H,38,39)(H,40,41)(H4,25,27,31,32,37)/t13-,14-,15-/m0/s1 Image of MNXM1104336
SMILES (mnx)[CH:1]1=[CH:3][C:12]([NH:26][CH2:9][C@H:13]2[CH2:10][NH:27][C:19]3=[C:18]([C:21]([OH:37])=[N:32][C:24](=[NH:25])[NH:31]3)[NH:28]2)=[CH:4][CH:2]=[C:11]1[C:20]([NH:30][C@@H:15]([CH2:5][CH2:7][C:16](=[N:29][C@@H:14]([CH2:6][CH2:8][C:17](=[O:34])[OH:35])[C:22](=[O:38])[OH:39])[OH:33])[C:23](=[O:40])[OH:41])=[O:36]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)6
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

kegg.compound:C09332
keggC:C09332
ZAOGJXDWOQXFBW-KKUMJFAQSA-N 		THF-L-glutamate
(6S)-H4PteGlu2
Tetrahydropteroyldiglutamate

CHEBI:27650
chebi:27650
ZAOGJXDWOQXFBW-FGRDXJNISA-N 		5,6,7,8-tetrahydrofolyl-L-glutamic acid
N-[(4-{[(2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl)methyl]amino}phenyl)carbonyl]-L-gamma-glutamyl-L-glutamic acid
THF-L-glutamate
Tetrahydrofolyl-[Glu](2)

bigg.metabolite:thfglu
biggM:thfglu
ZAOGJXDWOQXFBW-FGRDXJNISA-N 		Tetrahydrofolyl Glu 2
hmdb:HMDB0006825
ZAOGJXDWOQXFBW-UHFFFAOYSA-N 		Tetrahydrofolyl-[Glu](2)
(6S)-H4PteGlu2
2-{4-[(4-{[(2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl)methyl]amino}phenyl)formamido]-4-carboxybutanamido}pentanedioic acid
2-{4-[(4-{[(2-amino-4-oxo-5,6,7,8-tetrahydro-3H-pteridin-6-yl)methyl]amino}phenyl)formamido]-4-carboxybutanamido}pentanedioic acid
THF-L-Glutamate
THF-L-Glutamic acid
THF-Polyglutamate
Tetrahydrofolyl-[glu](n+1)
Tetrahydropteroyl-[gamma-glu]N
Tetrahydropteroyl-[gamma-glu]n+1
Tetrahydropteroyldiglutamate
Tetrahydropteroyldiglutamic acid

seed.compound:cpd19097
seedM:cpd19097
ZAOGJXDWOQXFBW-KKUMJFAQSA-N 		Tetrahydrofolyl-[Glu](2)
(6S)-H4PteGlu2
H4PteGlu2
THF-L-glutamate
Tetrahydropteroyldiglutamate
tetrahydrofolate glutamate
tetrahydropteroyl di-L-glutamate

vmhM:thfglu
vmhmetabolite:thfglu
ZAOGJXDWOQXFBW-UHFFFAOYSA-K 		Tetrahydrofolyl-[Glu](2)
2-{4-[(4-{[(2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl)methyl]amino}phenyl)formamido]-4-carboxybutanamido}pentanedioic acid

sabiork.compound:11422
sabiorkM:11422
ZAOGJXDWOQXFBW-FGRDXJNISA-N 		Tetrahydrofolyl-[Glu](2)
THF-L-glutamate

sabiork.compound:31042
sabiorkM:31042
ZAOGJXDWOQXFBW-KKUMJFAQSA-K 		Tetrahydropteroyl di-L-glutamate
H4PteGlu2

metacyc.compound:CPD-17108
metacycM:CPD-17108
ZAOGJXDWOQXFBW-KKUMJFAQSA-K 		tetrahydropteroyl di-L-glutamate
H4PteGlu2

hmdb:HMDB06825
chebi:26909
chebi:9483
biggM:M_thfglu
keggC:M_C09332
seedM:M_cpd19097
vmhM:M_thfglu 		secondary/obsolete/fantasy identifier