Amino{4-[(2-O-Hexopyranosylhexopyranosyl)Oxy]Phenyl}Acetic Acid

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Formula C20H29NO13
IUPAC Name (2s)-2-amino-2-[4-[(2r,3s,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2r,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxyphenyl]acetic acid
Molecular Mass 491.443 g·mol−1
Heat of Formation -2311.7 ± 16.7 kJ·mol−1
Dipole Moment 5.62 ± 1.08 D
Volume 541.84 Å 3
Surface Area 437.96 Å 2
HOMO Energy -9.47 ± 0.55 eV
LUMO Energy -0.30 ± eV
Point Group Symmetry C1
InChIKey PHPOPZGUOBMSPZ-QHJSCRBTSA-N
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