Chem
J-GLOBAL ID:200907004436101347
Nikkaji number:J2.198.753K
3,3′-Dithiobis[(2S,3R)-2-(15 N)amino-(1,2,3-13 C3 ,3-2 H)propanoic acid]
3,3′-ジチオビス[(2S,3R)-2-(15 N)アミノ-(1,2,3-13 C3 ,3-2 H)プロパン酸]
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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:
[13 C]6 H10 [2 H]2 [15 N]2 O4 S2
Molecular formula furigana:
C6-H12-N2-O4-S2
Molecular weight:
250.240
InChI:
InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)/t3-,4-/m1/s1/i1+1D,2+1D,3+1,4+1,5+1,6+1,7+1,8+1/t1-,2-,3-,4-
InChI key:
LEVWYRKDKASIDU-VLARQPKDSA-N
SMILES:
[13CH]([2H])(SS[13CH]([2H])[13C@@H]([15NH2])[13C](=O)O)[13C@@H]([15NH2])[13C](=O)O
Systematic name (3):
3,3′-ジチオビス[(2S,3R)-2-(15 N)アミノ-(1,2,3-13 C3 ,3-2 H)プロパン酸]
(2S,3R)-2-アミノ-3-{[(1R,2S)-2-アミノ-2-カルボキシ(,1,2-13 C3, 1-2 H1 )エチル]ジスルファニル}(1,2,3-13 C3, 3-2 H1 )プロパン酸
(2S,3R)-2-amino-3-{[(1R,2S)-2-amino-2-carboxy(,1,2-13 C3, 1-2 H1 )ethyl]disulfanyl}(1,2,3-13 C3, 3-2 H1 )propanoic acid
Other name (1):
3,3′-Dithiobis[(2S,3R)-2-(15 N)amino-(1,2,3-13 C3 ,3-2 H)propanoic acid]
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