Account (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-diol
- Catalog No. :
- ACHEYW065
- CAS No. :
- 74007-20-8
- Molecular Formula :
- C28H44O2
- Molecular Weight :
- 412.66
IUPAC Name:(1R,3S,E)-5-(2-((1R,3aS,7aR,E)-1-((2R,5R,E)-5,6-dimethylhept-3-en-2-yl)-7a-methyloctahydro-4H-inden-4-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diol
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Product Information
| Product Name | (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-diol |
|---|---|
| IUPAC Name | (1R,3S,E)-5-(2-((1R,3aS,7aR,E)-1-((2R,5R,E)-5,6-dimethylhept-3-en-2-yl)-7a-methyloctahydro-4H-inden-4-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diol |
| Molecular Formula | C28H44O2 |
| Molecular Weight | 412.66 |
| SMILES | O[C@H]1C[C@H](O)C(/C(C1)=C/C=C2[C@]3([H])CC[C@H]([C@@H](/C=C/[C@H](C)C(C)C)C)[C@@]3(C)CCC/2)=C |
| InChI Key | HKXBNHCUPKIYDM-HBZIUUSASA-N |
| Synonym | (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-diol | DTXSID1034214 | AKOS025402434 | trans-Doxercalciferol | DTXSID50860671 | AC-906 | |
| CAS No. | 74007-20-8 |
| PubChem CID | 46705423 |
Safety Data
- Pictogram
- Signal Word
- Danger
- Hazard Statement(s)
- H300
- Precautionary Statement(s)
- P264-P270-P301+P310-P321-P330-P405-P501
Synthetic Route by SureRoute
2. ACHEYW065 Molecular Building Block Synthetic Route
(1R,3S,Z)-5-((E)-2-((1R,3aS,7aR)-7a-Methyl-1-((R)-6-methylheptan-2-yl)hexahydro-1H-inden-4(2H)-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diol
(1S,3S,Z)-5-((E)-2-((1R,3AS,7aR)-7a-Methyl-1-((R)-6-methylheptan-2-yl)hexahydro-1H-inden-4(2H)-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diol
(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-diol