(5S)-2,3-Anhydro-4-Deoxy-5-{(1S)-1-[(4Br,6R,6Ar,10Ar,10Bs)-6,6A-Dihydroxy-10A-Methyl-10-Oxo-4B,5,6,6A,7,10,10A,10B,11,12-Decahydro-2-Chrysenyl]Ethyl}-α-L-Erythro-Pentopyranose

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Properties Simple | Detailed

Formula C26H32O6
IUPAC Name (4ar,4bs,10br,12r,12ar)-12,12a-dihydroxy-4a-methyl-8-vinyl-4b,5,6,10b,11,12-hexahydro-1h-chrysen-4-one; (2s,3s)-3-(2-oxoethyl)oxirane-2-carbaldehyde
Molecular Mass 440.529 g·mol−1
Heat of Formation -926.6 ± 16.7 kJ·mol−1
Dipole Moment 3.66 ± 1.08 D
Volume 513.28 Å 3
Surface Area 410.05 Å 2
HOMO Energy -9.05 ± 0.55 eV
LUMO Energy 2.62 ± eV
Point Group Symmetry C1
InChIKey SJMPBOBISFMUJY-CHESOGDCSA-N
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