Account 3-NBD-C12 Cholesterol
- Catalog No. :
- ACPEDN224
- CAS No. :
- 186833-02-3
- Molecular Formula :
- C46H72N4O5
- Molecular Weight :
- 761.10
IUPAC Name:(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-((R)-6-methylheptan-2-yl)-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl 12-(methyl(7-nitrobenzo[c][1,2,5]oxadiazol-4-yl)amino)dodecanoate
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Product Information
| Product Name | 3-NBD-C12 Cholesterol |
|---|---|
| IUPAC Name | (3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-((R)-6-methylheptan-2-yl)-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl 12-(methyl(7-nitrobenzo[c][1,2,5]oxadiazol-4-yl)amino)dodecanoate |
| Molecular Formula | C46H72N4O5 |
| Molecular Weight | 761.10 |
| SMILES | O=C(O[C@H]1CC[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@H]([C@@H](CCCC(C)C)C)CC[C@@]4([H])[C@]3([H])CC=C2C1)CCCCCCCCCCCN(C)C5=CC=C([N+]([O-])=O)C6=NON=C65 |
| InChI Key | MKEQHMRXIADXQQ-KLHFYLHASA-N |
| Synonym | 3-NBD-C12 Cholesterol;Cholest-5-en-3-ol (3β)-, 3-[12-[methyl(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]dodecanoate] |
| CAS No. | 186833-02-3 |
Synthetic Route by SureRoute
2. ACPEDN224 Molecular Building Block Synthetic Route
(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-((R)-6-methylheptan-2-yl)-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl 6-((7-nitrobenzo[c][1,2,5]oxadiazol-4-yl)amino)hexanoate
(3S,8S,9S,10R,13S,14S,17R)-10,13-dimethyl-17-((S)-1-((7-nitrobenzo[c][1,2,5]oxadiazol-4-yl)amino)propan-2-yl)-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol
12-(Methyl(7-nitrobenzo[c][1,2,5]oxadiazol-4-yl)amino)octadecanoic acid