(1R,3S,5Z)-5-[(2E)-2-{(1R,3As,7Ar)-1-[(2R,3E)-8-Hydroxy-8-Methyl-3-Nonen-2-Yl]-7A-Methyloctahydro-4H-Inden-4-Ylidene}Ethylidene]-4-Methylene-1,3-Cyclohexanediol

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Properties Simple | Detailed

Formula C29H46O3
IUPAC Name (3e)-3-[2-[2-[2-[2-[(z)-hept-1-en-3,5-diynyl]-3-(oxomethylene)cyclopropen-1-yl]ethynyl]-3-methyl-benzene-4,5,6-triid-1-yl]ethylidene]-2-methylene-5-(oxomethylene)cyclopentanone
Molecular Mass 442.674 g·mol−1
Heat of Formation 3215.1 ± 16.7 kJ·mol−1
Dipole Moment 2.98 ± 1.08 D
Volume 431.13 Å 3
Surface Area 373.68 Å 2
HOMO Energy -8.37 ± 0.55 eV
LUMO Energy -1.97 ± eV
Point Group Symmetry C1
InChIKey ZSRZLHUUFCGCDW-RYHWMDGISA-N
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