Actinorhodin

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Properties Simple | Detailed

Formula C32H26O14
IUPAC Name 2-[(1s,3r)-8-[(1s,3r)-3-(carboxymethyl)-5,10-dihydroxy-1-methyl-6,9-dioxo-3,4-dihydro-1h-benzo[g]isochromen-8-yl]-5,10-dihydroxy-1-methyl-6,9-dioxo-3,4-dihydro-1h-benzo[g]isochromen-3-yl]acetic acid
Molecular Mass 634.540 g·mol−1
Heat of Formation -2260.9 ± 16.7 kJ·mol−1
Dipole Moment 1.02 ± 1.08 D
Volume 663.04 Å 3
Surface Area 549.24 Å 2
HOMO Energy -9.33 ± 0.55 eV
LUMO Energy -2.35 ± eV
Point Group Symmetry C1
InChIKey FXTIILIJTTYSLT-NNYUYHANSA-N
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