5,7-Dihydroxy-2-(4-Methoxyphenyl)-4-Oxo-4H-Chromen-3-Yl 2-O-(6-Deoxy-α-L-Erythro-Hexopyranosyl)-Beta-D-Threo-Hexopyranoside

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Properties Simple | Detailed

Formula C28H24O15
IUPAC Name ethynol; [(1r,2s,3z)-2-[(e,3z)-5-ethynyl-3-(2-hydroxy-3-oxo-prop-2-enylidene)-6,9,12-trioxo-dodec-4-en-1,7,10-triynyl]-3-(hydroxymethylene)cyclopropyl] penta-2,4-diynoate; hydron; hexahydrate
Molecular Mass 609.553 g·mol−1
Heat of Formation -1318.9 ± 16.7 kJ·mol−1
Dipole Moment 6.39 ± 1.08 D
Volume 749.68 Å 3
Surface Area 529.07 Å 2
HOMO Energy -8.65 ± 0.55 eV
LUMO Energy -1.62 ± eV
Point Group Symmetry C1
InChIKey BZRYTCVZZLOPIO-SAKOMACMSA-N
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