(2S)-2-azaniumyl-3-[(2S,3S)-3-methyl-3-oxidanyl-oxan-2-yl]sulfanyl-propanoate

Systemtic Name: (2S)-2-azaniumyl-3-[(2S,3S)-3-methyl-3-oxidanyl-oxan-2-yl]sulfanyl-propanoate Openeye Name: (2S)-2-azaniumyl-3-[(2S,3S)-3-hydroxy-3-methyl-tetrahydropyran-2-yl]sulfanyl-propanoate CAS Name: (2S)-2-ammonio-3-[[(2S,3S)-3-hydroxy-3-methyl-2-oxanyl]thio]propanoate IUPAC Name: (2S)-2-azaniumyl-3-[(2S,3S)-3-hydroxy-3-methyloxan-2-yl]sulfanylpropanoate Traditional Name: (2S)-2-ammonio-3-[[(2S,3S)-3-hydroxy-3-methyl-tetrahydropyran-2-yl]thio]propionate Formula: C9H17NO4S MolecularWeight: 235.30058

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCOC1SCC(C(=O)[O-])[NH3+])O

Isomeric SMILES

C[C@@]1(CCCO[C@H]1SC[C@H](C(=O)[O-])[NH3+])O

InChI

InChI=1S/C9H17NO4S/c1-9(13)3-2-4-14-8(9)15-5-6(10)7(11)12/h6,8,13H,2-5,10H2,1H3,(H,11,12)/t6-,8+,9+/m1/s1