(5E,7E,22E)-9,10-Secoergosta-5,7,10(19),22-tetraen-3beta-OL
(1S,3E)-3-[(2E)-2-[(1R,3aS,7aR)-1-[(E,2R,5R)-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: 5,6-trans-Vitamin D2|ergocalciferol|Ergocalciferolo|Ergocalciferols|Calciferol|Calciferolum|Crystallina|Mulsiferol|Condocaps|Deltalin|Ergorone|Fortodyl|Hyperkil|Mykostin|Radiostol|Radsterin|Sterogyl|Vigantol|Viosterol|Davitin|Deratol|Detalup|Diactol|Disdrol|Drisdol|Geltabs|Metadee|Ostelin|Rodinec|Condol|Decaps|Ertron|Infron|Daral|Doral|Ergocalciferolum|Shock-ferol|Divit urto|Novovitamin-D|trans-Vitamin D2|D-Tracetten|Davitamon D|Dee-Osterol|Hi-Deratol|Calciferon 2|Dee-Ronal|Dee-Roual|Oleovitamin D2|Vitavel-D|D-Arthin
| Molecular Formula | C28H44O |
|---|---|
| Molecular Weight | 396.3392 g/mol |
| LogP | 7.641 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 396.3392 |
| Monoisotopic Mass | 396.3392 |
| Heavy Atoms | 29 |
| Complexity | 678.42737 |
Chemical Identifiers
| CAS Number | 51744-66-2 |
|---|---|
| SMILES | C[C@H](/C=C/[C@H](C)C(C)C)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C\3/C[C@H](CCC3=C)O)C |
Product Overview
(5E,7E,22E)-9,10-Secoergosta-5,7,10(19),22-tetraen-3beta-OL (CAS 51744-66-2), with molecular formula C28H44O and molecular weight 396.3392 g/mol. IUPAC: (1S,3E)-3-[(2E)-2-[(1R,3aS,7aR)-1-[(E,2R,5R)-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.
(5E,7E,22E)-9,10-Secoergosta-5,7,10(19),22-tetraen-3beta-OL is a custom synthesis product. We offer services from milligram to kilogram scale.
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