(3β,5Alpha,6β,22E)-5,6-Dihydroxyergosta-7,22-Dien-3-Yl β-D-Glucopyranoside

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Properties Simple | Detailed

Formula C25H18O8
IUPAC Name carbon dioxide; (13e)-8,12-dimethylene-13-(2-methylenecyclopropylidene)-4-(oxomethylene)bicyclo[7.7.0]hexadeca-6,10,14-triyne-3,5-dione; hydroperoxymethanolate
Molecular Mass 446.406 g·mol−1
Heat of Formation -1726.3 ± 16.7 kJ·mol−1
Dipole Moment 3.55 ± 1.08 D
Volume 752.42 Å 3
Surface Area 571.4 Å 2
HOMO Energy -9.47 ± 0.55 eV
LUMO Energy 3.91 ± eV
Point Group Symmetry C1
InChIKey OHZYISZWOVEBCJ-ATLCLBDSSA-N
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Elements H C O