Cas no 1225451-00-2 ((R,R,S,S)-Orlistat)
(R,R,S,S)-Orlistat structure
Product Name:(R,R,S,S)-Orlistat
CAS No:1225451-00-2
MF:C29H53NO5
MW:495.73482966423
MDL:MFCD28988915
CID:1059865
PubChem ID:16760542
Update Time:2025-04-20
(R,R,S,S)-Orlistat Chemical and Physical Properties
Names and Identifiers
-
- (R,R,S,S)-Orlistat
- (2R)-1-[(2S,3S)-3-Hexyl-4-oxo-2-oxetanyl]-2-tridecanyl N-formyl-D -leucinate
- AKOS030241555
- J-002583
- N-formyl-D-leucine (R)-1-[[(2S,3S)-3-hexyl-4-oxo-2-oxetanyl]methyl]dodecyl ester
- 111466-63-8
- (R)-1-((2S,3S)-3-Hexyl-4-oxooxetan-2-yl)tridecan-2-yl formyl-D-leucinate
- 1225451-00-2
- [(2R)-1-[(2S,3S)-3-hexyl-4-oxooxetan-2-yl]tridecan-2-yl] (2R)-2-formamido-4-methylpentanoate
- CHEMBL472695
- AHLBNYSZXLDEJQ-RAVGUYNFSA-N
- (2R)-1-[(2S,3S)-3-HEXYL-4-OXOOXETAN-2-YL]TRIDECAN-2-YL (2R)-2-FORMAMIDO-4-METHYLPENTANOATE
- BDBM50465318
- EN300-24765849
- (S,R,S,S)-Orlistat
-
- MDL： MFCD28988915
- Inchi： 1S/C29H53NO5/c1-5-7-9-11-12-13-14-15-16-18-24(34-29(33)26(30-22-31)20-23(3)4)21-27-25(28(32)35-27)19-17-10-8-6-2/h22-27H,5-21H2,1-4H3,(H,30,31)/t24-,25+,26-,27+/m1/s1
- InChI Key： AHLBNYSZXLDEJQ-RAVGUYNFSA-N
- SMILES： O1C([C@@H](CCCCCC)[C@@H]1C[C@@H](CCCCCCCCCCC)OC([C@@H](CC(C)C)NC=O)=O)=O
Computed Properties
- Exact Mass: 495.39200
- Monoisotopic Mass: 495.39237379g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 35
- Rotatable Bond Count: 23
- Complexity: 579
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 4
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 10
- Topological Polar Surface Area: 81.7?2
Experimental Properties
- PSA: 85.19000
- LogP: 7.72220
(R,R,S,S)-Orlistat Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | O686465-25mg |
(R,R,S,S)-Orlistat |
1225451-00-2 | 25mg |
$9225.00 | 2023-05-17 | ||
| TRC | O686465-50mg |
(R,R,S,S)-Orlistat |
1225451-00-2 | 50mg |
$ 12800.00 | 2023-09-06 | ||
| Enamine | EN300-24765849-0.05g |
(2R)-1-[(2S,3S)-3-hexyl-4-oxooxetan-2-yl]tridecan-2-yl (2R)-2-formamido-4-methylpentanoate |
1225451-00-2 | 95% | 0.05g |
$2755.0 | 2024-06-19 |
(R,R,S,S)-Orlistat Related Literature
-
Jonas Kind,Lukas Kaltschnee,Martin Leyendecker,Christina M. Thiele Chem. Commun., 2016,52, 12506-12509
-
Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
-
Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
-
J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
1225451-00-2 ((R,R,S,S)-Orlistat) Related Products
- 130793-27-0(N-Formyl-L-leucine (3S,4R,6S)-3-Hexyltetrahydro-2-oxo-6-undecyl-2H-pyran-4-yl Ester)
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- 111466-62-7((S,S,R,R)-Orlistat)
- 111466-63-8((S,R,S,S)-Orlistat)
- 96829-58-2(Orlistat)
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- 104872-28-8((R,S,S,S)-Orlistat)
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- 1356847-30-7(5-Methyl-L-norleucine Orlistat Analogue)
- 1243011-56-4(Octyl Orlistat)
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