(1S,7S,10S,13S,14R)-7-[(3S,5S)-3,5-dihydroxy-2-methylcyclohex-1-en-1-yl]-13-[(2S)-6-hydroxy-6-methylheptan-2-yl]-14-methyl-4-phenyl-2,4,6-triazatetracyclo[7.7.0.0²,⁶.0¹⁰,¹⁴]hexadec-8-ene-3,5-dione
Structure Info
- Chemspace ID
- CSSB02125551015 (In-Stock Building Blocks)
- IUPAC Name
- (1S,7S,10S,13S,14R)-7-[(3S,5S)-3,5-dihydroxy-2-methylcyclohex-1-en-1-yl]-13-[(2S)-6-hydroxy-6-methylheptan-2-yl]-14-methyl-4-phenyl-2,4,6-triazatetracyclo[7.7.0.0²,⁶.0¹⁰,¹⁴]hexadec-8-ene-3,5-dione
- Mol formula
- C35H49N3O5
- Mol weight
- 592 Da
- Catalog Number(s)
- 259606, APB86307440, APS86307440, B0504-485045, Y1240345, ZXC177238
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 4.45
- Heavy atoms count
- 43
- Rotatable bond count
- 7
- Number of rings
- 6
- Carbon bond saturation, Fsp3
- 0.657
- Polar surface area (Å)
- 105
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 3
- Zoom the structure
- CSSB02125551015
Items Overall 1 item from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| BOC Sciences | 24 days | United States To: | 98 | 1 mg | 218.90 | |
Description: CAS: 86307-44-0 | ||||||
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![Chemical structure of (1R,7S,10R,13R,14R)-7-[(3S,5R)-3,5-dihydroxy-2-methylcyclohex-1-en-1-yl]-13-[(2R)-6-hydroxy-6-methylheptan-2-yl]-14-methyl-4-phenyl-2,4,6-triazatetracyclo[7.7.0.0²,⁶.0¹⁰,¹⁴]hexadec-8-ene-3,5-dione - CSSB00161189303](/st/structure/200/9dc16e74e9e3c9c10313ccf626711cce/C%255BC%2540H%255D%2528CCCC%2528C%2529%2528C%2529O%2529%255BC%2540H%255D1CC%255BC%2540H%255D2C3%253DC%255BC%2540H%255D%2528N4N%2528%255BC%2540%2540H%255D3CC%255BC%2540%255D12C%2529C%2528%253DO%2529N%2528C4%253DO%2529C1%253DCC%253DCC%253DC1%2529C1%253DC%2528C%2529%255BC%2540%2540H%255D%2528O%2529C%255BC%2540H%255D%2528O%2529C1.png)
![Chemical structure of (10R,13R,14R)-7-[(3S,5R)-3,5-dihydroxy-2-methylcyclohex-1-en-1-yl]-13-[(2R)-6-hydroxy-6-methylheptan-2-yl]-14-methyl-4-phenyl-2,4,6-triazatetracyclo[7.7.0.0²,⁶.0¹⁰,¹⁴]hexadec-8-ene-3,5-dione - CSSB14948339266](/st/structure/200/db7c7ab977b532c51b6561497ee0e878/C%255BC%2540H%255D%2528CCCC%2528C%2529%2528C%2529O%2529%255BC%2540H%255D1CC%255BC%2540H%255D2C3%253DCC%2528N4N%2528C3CC%255BC%2540%255D12C%2529C%2528%253DO%2529N%2528C4%253DO%2529C1%253DCC%253DCC%253DC1%2529C1%253DC%2528C%2529%255BC%2540%2540H%255D%2528O%2529C%255BC%2540H%255D%2528O%2529C1.png)
![Chemical structure of (1R,10R,13S,14S)-7-[(3R,5S)-3,5-dihydroxy-2-methylcyclohex-1-en-1-yl]-13-[(2S)-6-hydroxy-6-methylheptan-2-yl]-14-methyl-4-phenyl-2,4,6-triazatetracyclo[7.7.0.0²,⁶.0¹⁰,¹⁴]hexadec-8-ene-3,5-dione - CSSB20621783882](/st/structure/200/28790f8337b2f938d3afb60d535b10d5/C%255BC%2540%2540H%255D%2528CCCC%2528C%2529%2528C%2529O%2529%255BC%2540%2540H%255D1CC%255BC%2540H%255D2C3%253DCC%2528N4N%2528%255BC%2540%2540H%255D3CC%255BC%2540%2540%255D12C%2529C%2528%253DO%2529N%2528C4%253DO%2529C1%253DCC%253DCC%253DC1%2529C1%253DC%2528C%2529%255BC%2540H%255D%2528O%2529C%255BC%2540%2540H%255D%2528O%2529C1.png)
![Chemical structure of (1R,7S,10R,13R,14R)-7-[(3S,5S)-3,5-dihydroxy-2-methylcyclohex-1-en-1-yl]-14-methyl-13-[(2R)-6-methylheptan-2-yl]-4-phenyl-2,4,6-triazatetracyclo[7.7.0.0²,⁶.0¹⁰,¹⁴]hexadec-8-ene-3,5-dione - CSSB02515438070](/st/structure/200/32eed6070e54e3dec005cbe2cadc4d87/CC%2528C%2529CCC%255BC%2540%2540H%255D%2528C%2529%255BC%2540H%255D1CC%255BC%2540H%255D2C3%253DC%255BC%2540H%255D%2528N4N%2528%255BC%2540%2540H%255D3CC%255BC%2540%255D12C%2529C%2528%253DO%2529N%2528C4%253DO%2529C1%253DCC%253DCC%253DC1%2529C1%253DC%2528C%2529%255BC%2540%2540H%255D%2528O%2529C%255BC%2540%2540H%255D%2528O%2529C1.png)
![Chemical structure of (10R,13R,14R)-7-[(3S,5R)-3,5-dihydroxy-2-methylcyclohex-1-en-1-yl]-14-methyl-13-[(2R)-6-methylheptan-2-yl]-4-phenyl-2,4,6-triazatetracyclo[7.7.0.0²,⁶.0¹⁰,¹⁴]hexadec-8-ene-3,5-dione - CSSB00161189304](/st/structure/200/b8501acd4d26295daba0539d1c96f94c/CC%2528C%2529CCC%255BC%2540%2540H%255D%2528C%2529%255BC%2540H%255D1CC%255BC%2540H%255D2C3%253DCC%2528N4N%2528C3CC%255BC%2540%255D12C%2529C%2528%253DO%2529N%2528C4%253DO%2529C1%253DCC%253DCC%253DC1%2529C1%253DC%2528C%2529%255BC%2540%2540H%255D%2528O%2529C%255BC%2540H%255D%2528O%2529C1.png)
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