Account ((1R,3S,E)-5-((E)-2-((1R,3aS,7aR)-1-((2R,5S)-5,6-dimethylheptan-2-yl)-7a-methyldihydro-1H-inden-4(2H,5H,6H,7H,7aH)-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diyl)bis(oxy)bis(tert-butyldimethylsilane)
- Catalog No. :
- ACOTUB951
- CAS No. :
- 2229745-37-1
- Molecular Formula :
- C40H74O2Si2
- Molecular Weight :
- 643.20
IUPAC Name:(((1R,3S,E)-5-(2-((1R,3aS,7aR,E)-1-((2R,5S)-5,6-dimethylheptan-2-yl)-7a-methyloctahydro-4H-inden-4-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diyl)bis(oxy))bis(tert-butyldimethylsilane)
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Product Information
| Product Name | ((1R,3S,E)-5-((E)-2-((1R,3aS,7aR)-1-((2R,5S)-5,6-dimethylheptan-2-yl)-7a-methyldihydro-1H-inden-4(2H,5H,6H,7H,7aH)-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diyl)bis(oxy)bis(tert-butyldimethylsilane) |
|---|---|
| IUPAC Name | (((1R,3S,E)-5-(2-((1R,3aS,7aR,E)-1-((2R,5S)-5,6-dimethylheptan-2-yl)-7a-methyloctahydro-4H-inden-4-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diyl)bis(oxy))bis(tert-butyldimethylsilane) |
| Molecular Formula | C40H74O2Si2 |
| Molecular Weight | 643.20 |
| SMILES | C=C1/C(=C/C=C2\CCC[C@]3(C)[C@@H]([C@H](C)CC[C@H](C)C(C)C)CC[C@@H]23)C[C@@H](O[Si](C)(C)C(C)(C)C)C[C@@H]1O[Si](C)(C)C(C)(C)C |
| InChI Key | PWMVYLIDCDDJNG-YATUPEMTSA-N |
| Synonym | 23,24-dihydroergo-calciferol;Doxercalciferol Impurity 16;Calcipotriol Impurity 18;1H-Indene, 4-[(2E)-2-[(3S,5R)-3,5-bis[[(1,1-dimethylethyl)dimethylsilyl]oxy]-2-methylenecyclohexylidene]ethylidene]octahydro-7a-methyl-1-[(1R,4S)-1,4,5-trimethylhexyl]-, (1R,3aS,4E,7aR)-;(1R,3aS,4E,7aR)-4-[(2E)-2-[(3S,5R)-3,5-bis[[(1,1-dimethylethyl)dimethylsilyl]oxy]-2-methylenecyclohexylidene]ethylidene]octahydro-7a-methyl-1-[(1R,4S)-1,4,5-trimethylhexyl]-1H-Indene;Doxercalciferol Impurity 6;((1R,3S,E)-5-((E)-2-((1R,3aS,7aR)-1-((2R,5S)-5,6-Dimethylheptan-2-yl)-7a-methyldihydro-1H-inden-4(2H,5H,6H,7H,7aH)-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diyl)bis(oxy)bis(tert-butyldimethylsilane) - [D88313];Vitamin impurity 4 |
| CAS No. | 2229745-37-1 |
Synthetic Route by SureRoute
2. ACOTUB951 Molecular Building Block Synthetic Route
(((1R,3S,E)-5-(2-((1R,3aS,7aR,E)-7a-Methyl-1-((R)-6-methylheptan-2-yl)octahydro-4H-inden-4-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diyl)bis(oxy))bis(tert-butyldimethylsilane)
((1R,3R,E)-5-((E)-2-((1R,3aS,7aR)-1-((2R,5R,E)-5,6-dimethylhept-3-en-2-yl)-7a-methyldihydro-1H-inden-4(2H,5H,6H,7H,7aH)-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diyl)bis(oxy)bis(tert-butyldimethylsilane)
((1R,3S,E)-5-((E)-2-((1R,3aS,7aR)-1-((2R,5R,E)-5,6-dimethylhept-3-en-2-yl)-7a-methyldihydro-1H-inden-4(2H,5H,6H,7H,7aH)-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diyl)bis(oxy)bis(tert-butyldimeth ylsilane)