(6R,7S,10Z)-10-(2-Amino-1,3-Thiazol-4-Yl)-1-(1,5-Dihydroxy-4-Oxo-1,4-Dihydro-2-Pyridinyl)-7-Formyl-13,13-Dimethyl-3,9-Dioxo-6-(Sulfoamino)-12-Oxa-2,4,8,11-Tetraazatetradec-10-En-14-Oic Acid

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Properties Simple | Detailed

Formula C20H26N8O12S2
IUPAC Name 2-[(z)-[1-(2-aminothiazol-4-yl)-2-[[(1s,2r)-3-[(1,5-dihydroxy-4-oxo-2-pyridyl)methylcarbamoylamino]-1-formyl-2-(sulfoamino)propyl]amino]-2-oxo-ethylidene]amino]oxy-2-methyl-propanoic acid
Molecular Mass 634.597 g·mol−1
Heat of Formation 873.2 ± 16.7 kJ·mol−1
Dipole Moment 17.57 ± 1.08 D
Volume 604.67 Å 3
Surface Area 500.06 Å 2
HOMO Energy -9.67 ± 0.55 eV
LUMO Energy -4.29 ± eV
Point Group Symmetry C1
InChIKey DRGQACYRFXBYPT-SATPWBBZSA-N
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