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(2S)-3-phosphonooxy-2-(7-sulfanylheptanoylamino)butanoic acid

(2S)-3-phosphonooxy-2-(7-sulfanylheptanoylamino)butanoic acid

Systemtic Name:(2S)-3-phosphonooxy-2-(7-sulfanylheptanoylamino)butanoic acid
Openeye Name:(2S)-3-phosphonooxy-2-(7-sulfanylheptanoylamino)butanoic acid
CAS Name:(2S)-2-[(7-mercapto-1-oxoheptyl)amino]-3-phosphonooxybutanoic acid
IUPAC Name:(2S)-3-phosphonooxy-2-(7-sulfanylheptanoylamino)butanoic acid
Traditional Name:(2S)-2-(7-mercaptoheptanoylamino)-3-phosphonooxy-butyric acid
Formula: C11H22NO7PS
MolecularWeight: 343.333641
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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NC(=O)CCCCCCS)OP(=O)(O)O


Isomeric SMILES

CC([C@@H](C(=O)O)NC(=O)CCCCCCS)OP(=O)(O)O


InChI

InChI=1S/C11H22NO7PS/c1-8(19-20(16,17)18)10(11(14)15)12-9(13)6-4-2-3-5-7-21/h8,10,21H,2-7H2,1H3,(H,12,13)(H,14,15)(H2,16,17,18)/t8?,10-/m0/s1


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