(2R)-2-[(1R)-2-[(2S)-2-Amino-2-Carboxy-Ethoxy]-1-[[(2R)-2-[(4S)-2-Amino-4,5-Dihydrothiazol-4-Yl]-2-(Methoxyamino)Acetyl]Amino]-2-Oxo-Ethyl]-5-Methyl-3,6-Dihydro-2H-1,3-Thiazine-4-Carboxylic Acid

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Properties Simple | Detailed

Formula C17H27N6O8S2+
IUPAC Name (2r)-2-[(1r)-2-[(2s)-2-amino-2-carboxy-ethoxy]-1-[[(2r)-2-[(4s)-2-amino-4,5-dihydrothiazol-4-yl]-2-(methoxyamino)acetyl]amino]-2-oxo-ethyl]-5-methyl-3,6-dihydro-2h-1,3-thiazine-4-carboxylic acid
Molecular Mass 507.562 g·mol−1
Heat of Formation -1187.2 ± 16.7 kJ·mol−1
Dipole Moment 4.21 ± 1.08 D
Volume 558.0 Å 3
Surface Area 449.28 Å 2
HOMO Energy -8.75 ± 0.55 eV
LUMO Energy -0.99 ± eV
Point Group Symmetry C1
InChIKey BJJLQDBWOOZXNR-HURACDMBSA-N
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