CID 30604
(1S)-3-[2-[(1R,3aS,7aR)-1-[(2R,5S)-6-hydroxy-5,6-dimethylhept-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-ol
Also Known As: 25-HYDROXYVITAMIN D2|CTK8F4007
| Molecular Formula | C28H44O2 |
|---|---|
| Molecular Weight | 412.33414 g/mol |
| LogP | 6.76 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 412.33414 |
| Heavy Atoms | 30 |
| Complexity | 719.4 |
Chemical Identifiers
| CAS Number | 21343-40-8 |
|---|---|
| SMILES | C[C@H](C=C[C@H](C)C(C)(C)O)[C@H]1CC[C@@H]2[C@@]1(CCCC2=CC=C3C[C@H](CCC3=C)O)C |
Product Overview
CID 30604 (CAS 21343-40-8), with molecular formula C28H44O2 and molecular weight 412.33414 g/mol. IUPAC: (1S)-3-[2-[(1R,3aS,7aR)-1-[(2R,5S)-6-hydroxy-5,6-dimethylhept-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-ol.
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