(1R,3S)-5-{2-[(1R,3aS,7aR)-1-[(2R,3E,5S)-5-cyclopropyl-5-hydroxypent-3-en-2-yl]-7a-methyl-octahydro-1H-inden-4-ylidene]ethylidene}-4-methylidenecyclohexane-1,3-diol
Structure Info
- Chemspace ID
- CSSB00020661719 (In-Stock Building Blocks)
- MFCD
- MFCD10567086, MFCD00866630, MFCD08060076
- IUPAC Name
- (1R,3S)-5-{2-[(1R,3aS,7aR)-1-[(2R,3E,5S)-5-cyclopropyl-5-hydroxypent-3-en-2-yl]-7a-methyl-octahydro-1H-inden-4-ylidene]ethylidene}-4-methylidenecyclohexane-1,3-diol
- Mol formula
- C27H40O3
- Mol weight
- 413 Da
- Catalog Number(s)
- AA007RGL, AA01FZCT, AA02ANE6, AB035480, AD62081, AG007RJD, AL62081, AR007S8D, AR02AO5Y, AY25177, BM56010, CSC020661719, EC007TP5, EC02APMQ, OR1034971, ST007T05, ST02AOXQ, TX007SP1, TX01G0L9, TX02AOMM
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.84
- Heavy atoms count
- 30
- Rotatable bond count
- 5
- Number of rings
- 4
- Carbon bond saturation, Fsp3
- 0.703
- Polar surface area (Å)
- 61
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 3
![Chemical structure of (1R,3S)-5-{2-[(1R,3aS,7aR)-1-[(2R,3E,5S)-5-cyclopropyl-5-hydroxypent-3-en-2-yl]-7a-methyl-octahydro-1H-inden-4-ylidene]ethylidene}-4-methylidenecyclohexane-1,3-diol (C27H40O3) - CSSB00020661719](/st/structure/200/8ba27b06a7ae1633a6a94a0fdf1d329f/C%255BC%2540H%255D%2528%255CC%253DC%255C%255BC%2540%2540H%255D%2528O%2529C1CC1%2529%255BC%2540H%255D1CC%255BC%2540H%255D2C%2528CCC%255BC%2540%255D12C%2529%253DCC%253DC1C%255BC%2540%2540H%255D%2528O%2529C%255BC%2540H%255D%2528O%2529C1%253DC.png "C27H40O3")
- Zoom the structure
- CSSB00020661719
Items Overall 33 items from 9 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| 1st Scientific LLC | 3 days | United States To: | 98 | 10 mg | 50.60 | |
| 1st Scientific LLC | 3 days | United States To: | 98 | 25 mg | 95.70 | |
| 1st Scientific LLC | 3 days | United States To: | 98 | 50 mg | 161.70 | |
Description: (1R,3S,Z)-5-((E)-2-((1R,3aS,7aR)-1-((2R,5S,E)-5-cyclopropyl-5-hydroxypent-3-en-2-yl)-7a-methylhexahydro-1H-inden-4(2H)-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diol; CAS: 112965-21-6 | ||||||
| AboundChem | 5 days | United States To: | 98 | 5 mg | 97.90 | |
| AboundChem | 5 days | United States To: | 98 | 10 mg | 135.30 | |
| AboundChem | 5 days | United States To: | 98 | 25 mg | 243.10 | |
Description: Name: Calcipotriene; CAS: 112965-21-6 | ||||||
| Angene International Limited | 10 days | China To: | 98 | 25 mg | 104.40 | |
| Angene International Limited | 10 days | China To: | 98 | 50 mg | 175.50 | |
| Angene International Limited | 10 days | China To: | 98 | 100 mg | 224.10 | |
| Angene International Limited | 10 days | China To: | 98 | 250 mg | 423.90 | |
| Angene International Limited | 10 days | China To: | 98 | 1 g | 1,141.20 | |
Description: (1R,3S,Z)-5-((E)-2-((1R,3aS,7aR)-1-((2R,5S,E)-5-cyclopropyl-5-hydroxypent-3-en-2-yl)-7a-methylhexahydro-1H-inden-4(2H)-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diol; CAS: 112965-21-6 | ||||||
| AA BLOCKS | 12 days | United States To: | 98 | 10 mg | 60.50 | |
| AA BLOCKS | 12 days | United States To: | 98 | 25 mg | 114.40 | |
| AA BLOCKS | 12 days | United States To: | 98 | 50 mg | 194.70 | |
| AA BLOCKS | 12 days | United States To: | 98 | 100 mg | 328.90 | |
Description: (1R,3S,Z)-5-((E)-2-((1R,3aS,7aR)-1-((2R,5S,E)-5-cyclopropyl-5-hydroxypent-3-en-2-yl)-7a-methylhexahydro-1H-inden-4(2H)-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diol; CAS: 112965-21-6 | ||||||
| A2B Chem | 12 days | United States To: | 96 | 100 mg | 125.35 | |
| A2B Chem | 12 days | United States To: | 96 | 250 mg | 210.45 | |
| A2B Chem | 12 days | United States To: | 96 | 1 g | 426.65 | |
| A2B Chem | 12 days | United States To: | 96 | 5 g | 1,938.90 | |
Description: (1R,3S,E)-5-((E)-2-((1R,3aS,7aR)-1-((2R,5S,E)-5-Cyclopropyl-5-hydroxypent-3-en-2-yl)-7a-methylhexahydro-1H-inden-4(2H)-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diol; CAS: 910133-70-9 | ||||||
| Aaron Chemicals LLC | 12 days | United States To: | 96 | 100 mg | 141.45 | |
| Aaron Chemicals LLC | 12 days | United States To: | 96 | 250 mg | 238.05 | |
| Aaron Chemicals LLC | 12 days | United States To: | 96 | 1 g | 483.00 | |
| 1st Scientific CN | 14 days | China To: | 96 | 100 mg | 194.70 | |
| 1st Scientific CN | 14 days | China To: | 96 | 250 mg | 309.10 | |
| 1st Scientific CN | 14 days | China To: | 96 | 1 g | 599.50 | |
Description: (1R,3S,E)-5-((E)-2-((1R,3aS,7aR)-1-((2R,5S,E)-5-Cyclopropyl-5-hydroxypent-3-en-2-yl)-7a-methylhexahydro-1H-inden-4(2H)-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diol; CAS: 910133-70-9 | ||||||
| Accel Scientific, S.L. | 20 days | China To: | 96 | 100 mg | 138.60 | |
| Accel Scientific, S.L. | 20 days | China To: | 96 | 250 mg | 232.10 | |
| Accel Scientific, S.L. | 20 days | China To: | 96 | 1 g | 466.40 | |
Description: (1R,3S,E)-5-((E)-2-((1R,3aS,7aR)-1-((2R,5S,E)-5-Cyclopropyl-5-hydroxypent-3-en-2-yl)-7a-methylhexahydro-1H-inden-4(2H)-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diol; CAS: 910133-70-9 | ||||||
| 10X CHEM | TBD | United States To: | 90 | 5 mg | 41.80 | |
| 10X CHEM | TBD | United States To: | 90 | 10 mg | 50.60 | |
| 10X CHEM | TBD | United States To: | 90 | 25 mg | 95.70 | |
| 10X CHEM | TBD | United States To: | 90 | 50 mg | 162.80 | |
| 10X CHEM | TBD | United States To: | 90 | 250 mg | 786.50 | |
Description: (1R,3S,Z)-5-((E)-2-((1R,3aS,7aR)-1-((2R,5S,E)-5-cyclopropyl-5-hydroxypent-3-en-2-yl)-7a-methylhexahydro-1H-inden-4(2H)-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diol; CAS: 112965-21-6 | ||||||
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