Chem
J-GLOBAL ID：200907076855656732   Nikkaji number：J2.747.003C

Tetrahydropteroyltri-L-glutamate

テトラヒドロプテロイルトリ-L-グルタミン酸
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C29H37N9O12
Molecular formula furigana： C29-H37-N9-O12
Molecular weight： 703.666
InChI： InChI=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)/t15-,16-,17-,18-/m0/s1
InChI key： RXWVHRYZTWZATH-XSLAGTTESA-N
SMILES： Nc1nc2NC[C@H](CNc3ccc(cc3)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)Nc2c(=O)[nH]1
Systematic name  (3)：
  • N-[4-(2-アミノ-3,4,5,6,7,8-ヘキサヒドロ-4-オキソプテリジン-6β-イルメチルアミノ)ベンゾイル]-L-γGlu-L-γGlu-L-αGlu-OH
  • (2S)-2-[(4S)-4-[(4S)-4-{[4-({[(6S)-2-アミノ-4-オキソ-3,4,5,6,7,8-ヘキサヒドロプテリジン-6-イル]メチル}アミノ)フェニル]ホルムアミド}-4-カルボキシブタンアミド]-4-カルボキシブタンアミド]ペンタン二酸
  • (2S)-2-[(4S)-4-[(4S)-4-{[4-({[(6S)-2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)phenyl]formamido}-4-carboxybutanamido]-4-carboxybutanamido]pentanedioic acid
Other name (3)：
  • N-[4-(2-Amino-3,4,5,6,7,8-hexahydro-4-oxopteridine-6β-ylmethylamino)benzoyl]-L-γGlu-L-γGlu-L-αGlu-OH
  • Tetrahydropteroyltri-L-glutamate
  • テトラヒドロプテロイルトリ-L-グルタミン酸
KEGG COMPOUND： C04144
Thsaurus map：
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