RefChem:435441
2-[2-(1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-1-carbonyl)oxyethoxy]ethyl 1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-1-carboxylate
Also Known As: EINECS 204-131-6|oxydiethane-2,1-diyl bisabiet-8(14)-en-18-oate|Oxydi(ethane-2,1-diyl) diabiet-8(14)-en-18-oate|1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a-dimethyl-7-(1-methylethyl)-, oxydi-2,1-ethanediyl ester, (1R,1'R,4aS,4'aS,4bS,4'bS,7S,7'S,10aR,10'aR)-|1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a-dimethyl-7-(1-methylethyl)-, 1,1'-(oxydi-2,1-ethanediyl) ester, (1R,1'R,4aS,4'aS,4bS,4'bS,7S,7'S,10aR,10'aR)-|1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a-dimethyl-7-(1-methylethyl)-, oxydi-2,1-ethanediyl ester, (1R-(1alpha(1'R*,4'aS*,4'bS*,7'S*,10'aR*),4abeta,4balpha,7alpha,10|1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a-dimethyl-7-(1-methylethyl)-, oxydi-2,1-ethanediyl ester, [1R-[1.alpha.(1'R*,4'aS*,4'bS*,7'S*,10'aR*),4a.beta.,4b.alpha.,7.alpha.,10a.alpha.]]-|1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a-dimethyl-7-(1-methylethyl)-, oxydi-2,1-ethanediyl ester, [1R-[1alpha(1'R*,4'aS*,4'bS*,7'S*,10'aR*),4abeta,4balpha,7alpha,10aalpha]]-|2-[2-(1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-1-carbonyl)oxyethoxy]ethyl 1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-1-carboxylate
| Molecular Formula | C44H70O5 |
|---|---|
| Molecular Weight | 678.52234 g/mol |
| LogP | 10.52 |
| Topological Polar Surface Area | 61.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 678.52234 |
| Heavy Atoms | 49 |
| Complexity | 1183.7 |
Chemical Identifiers
| CAS Number | 116-22-3 |
|---|---|
| SMILES | CC(C)C1CCC2C(=C1)CCC3C2(CCCC3(C)C(=O)OCCOCCOC(=O)C4(CCCC5(C4CCC6=CC(CCC65)C(C)C)C)C)C |
Product Overview
RefChem:435441 (CAS 116-22-3), with molecular formula C44H70O5 and molecular weight 678.52234 g/mol. IUPAC: 2-[2-(1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-1-carbonyl)oxyethoxy]ethyl 1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-1-carboxylate.
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