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Tetrahydropteroyl-L-glutamate

MNXM739439 is deprecated and here replaced by MNXM1104689
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1104689 Image of MNXM1104689
referencesabiorkM:2729
formulaC29H37N9O12
global charge0
mol weight703.666
InChIKeyRXWVHRYZTWZATH-UHFFFAOYSA-N
InChIInChI=1S/C29H37N9O12/c30-29-37-23-22(25(44)38-29)33-15(12-32-23)11-31-14-3-1-13(2-4-14)24(43)36-18(28(49)50)6-9-20(40)34-16(26(45)46)5-8-19(39)35-17(27(47)48)7-10-21(41)42/h1-4,15-18,31,33H,5-12H2,(H,34,40)(H,35,39)(H,36,43)(H,41,42)(H,45,46)(H,47,48)(H,49,50)(H4,30,32,37,38,44)
SMILESN=C1N=C(O)C2=C(NCC(CNC3=CC=C(C(=O)NC(CCC(O)=NC(CCC(O)=NC(CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C=C3)N2)N1
MNX internals
InChI (mnx)InChI=1/C29H37N9O12/c30-29-37-23-22(25(44)38-29)33-15(12-32-23)11-31-14-3-1-13(2-4-14)24(43)36-18(28(49)50)6-9-20(40)34-16(26(45)46)5-8-19(39)35-17(27(47)48)7-10-21(41)42/h1-4,15-18,31,33H,5-12H2,(H,34,40)(H,35,39)(H,36,43)(H,41,42)(H,45,46)(H,47,48)(H,49,50)(H4,30,32,37,38,44)/t15?,16?,17?,18? Image of MNXM1104689
SMILES (mnx)[CH:1]1=[CH:3][C:14]([NH:31][CH2:11][CH:15]2[CH2:12][NH:32][C:23]3=[C:22]([C:25]([OH:44])=[N:38][C:29](=[NH:30])[NH:37]3)[NH:33]2)=[CH:4][CH:2]=[C:13]1[C:24]([NH:36][CH:18]([CH2:6][CH2:9][C:20](=[N:34][CH:16]([CH2:5][CH2:8][C:19](=[N:35][CH:17]([CH2:7][CH2:10][C:21](=[O:41])[OH:42])[C:27](=[O:47])[OH:48])[OH:39])[C:26](=[O:45])[OH:46])[OH:40])[C:28](=[O:49])[OH:50])=[O:43]
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

sabiork.compound:2729
sabiorkM:2729
RXWVHRYZTWZATH-UHFFFAOYSA-N 		Tetrahydropteroyl-L-glutamate
Tetrahydropteroyltri-L-glutamate
hmdb:HMDB0006826
RXWVHRYZTWZATH-UHFFFAOYSA-N 		Tetrahydrofolyl-[Glu](n)
2-(4-{4-[(4-{[(2-amino-4-oxo-1,4,5,6,7,8-hexahydropteridin-6-yl)methyl]amino}phenyl)formamido]-4-carboxybutanamido}-4-carboxybutanamido)pentanedioic acid
2-(4-{4-[(4-{[(2-amino-4-oxo-5,6,7,8-tetrahydro-1H-pteridin-6-yl)methyl]amino}phenyl)formamido]-4-carboxybutanamido}-4-carboxybutanamido)pentanedioic acid
THF-L-Glutamic acid
THF-Polyglutamate
Tetrahydrofolyl-[glu](n+1)
Tetrahydropteroyl-[gamma-glu]N
Tetrahydropteroyl-[gamma-glu]n+1
hmdb:HMDB0304498
RXWVHRYZTWZATH-UHFFFAOYSA-J 		tetrahydropteroyl tri-L-glutamate
2-(4-{4-[(4-{[(2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl)methyl]amino}phenyl)formamido]-4-carboxylatobutanamido}-4-carboxylatobutanamido)pentanedioate
2-(4-{4-[(4-{[(2-amino-4-oxo-5,6,7,8-tetrahydro-3H-pteridin-6-yl)methyl]amino}phenyl)formamido]-4-carboxylatobutanamido}-4-carboxylatobutanamido)pentanedioate
4-Carboxy-4-{[4-carboxy-4-({4-carboxy-4-[(4-{[(2-imino-4-oxido-1,2,5,6,7,8-hexahydropteridin-6-yl)methyl]amino}phenyl)formamido]-1-oxidobutylidene}amino)-1-oxidobutylidene]amino}butanoic acid
Tetrahydropteroyl tri-L-glutamic acid

hmdb:HMDB06826 		secondary/obsolete/fantasy identifier