Cas no 551-58-6 (Supinine)
Supinine structure
Product Name:Supinine
CAS No:551-58-6
MF:C15H25NO4
MW:283.363304853439
CID:371058
PubChem ID:108053
Update Time:2025-04-19
Supinine Chemical and Physical Properties
Names and Identifiers
-
- Butanoic acid,2,3-dihydroxy-2-(1-methylethyl)-,[(7aS)-2,3,5,7a-tetrahydro-1H-pyrrolizin-7-yl]methyl ester, (2S,3R)-
- [(8S)-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (2S)-2-hydroxy-2-[(1R)-1-hydroxyethyl]-3-methylbutanoate
- SUPININE
- Butanoic acid,2,3-dihydroxy-2-(1-methylethyl)-,((7aS)-2,3,5,7a-tetrahydro-1H-pyrrolizin-7-yl)methyl ester,(2S,3R)
- Butanoic acid,2,3-dihydroxy-2-(1-methylethyl)-,(2,3,5,7a-tetrahydro-1H-pyrrolizin-7-yl)methyl ester,(7aS-(7(2R*,3S*),7aR*))
- Supinin
- DTXCID00126113
- AKOS032946067
- CHEBI:9361
- NS00094779
- Butanoic acid, 2,3-dihydroxy-2-(1-methylethyl)-, (2,3,5,7a-tetrahydro-1H-pyrrolizin-7-yl)methyl ester, (7aS-(7(2R*,3S*),7aR*))-
- UNII-W11Q632E7K
- AI3-51772
- CS-0090485
- 551-58-6
- W11Q632E7K
- DTXSID70203622
- Butanoic acid, 2,3-dihydroxy-2-(1-methylethyl)-, ((7aS)-2,3,5,7a-tetrahydro-1H-pyrrolizin-7-yl)methyl ester, (2S,3R)-
- [(8S)-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (2S)-2-hydroxy-2-[(1R)-1-hydroxyethyl]-3-methyl-butanoate
- HY-122931
- Q27108360
- C10403
- Supinine
-
- Inchi： 1S/C15H25NO4/c1-10(2)15(19,11(3)17)14(18)20-9-12-6-8-16-7-4-5-13(12)16/h6,10-11,13,17,19H,4-5,7-9H2,1-3H3/t11-,13+,15+/m1/s1
- InChI Key： DRVWTOSBCBKXOR-ZLDLUXBVSA-N
- SMILES： O(C([C@@]([C@@H](C)O)(C(C)C)O)=O)CC1=CCN2CCC[C@H]21
Computed Properties
- Exact Mass: 283.17800
- Monoisotopic Mass: 283.178
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 20
- Rotatable Bond Count: 6
- Complexity: 407
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 3
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 70A^2
- XLogP3: 0.5
Experimental Properties
- Color/Form: Powder
- Density: 1.0662 (rough estimate)
- Melting Point: 148.5°C
- Boiling Point: 425.91°C (rough estimate)
- Flash Point: 205.9°C
- Refractive Index: 1.5000 (estimate)
- PSA: 70.00000
- LogP: 0.63980
Supinine Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | S515860-0.5mg |
Supinine |
551-58-6 | 0.5mg |
$ 170.00 | 2022-06-03 | ||
| TRC | S515860-2.5mg |
Supinine |
551-58-6 | 2.5mg |
$953.00 | 2023-05-17 | ||
| TRC | S515860-5mg |
Supinine |
551-58-6 | 5mg |
$1642.00 | 2023-05-17 | ||
| TRC | S515860-.5mg |
Supinine |
551-58-6 | 5mg |
$207.00 | 2023-05-17 | ||
| TRC | S515860-75mg |
Supinine |
551-58-6 | 75mg |
$ 23000.00 | 2023-09-06 | ||
| A2B Chem LLC | AG34358-5mg |
SUPININE |
551-58-6 | 98% by HPLC | 5mg |
$570.00 | 2024-04-19 | |
| A2B Chem LLC | AG34358-10mg |
SUPININE |
551-58-6 | 98% by HPLC | 10mg |
$938.00 | 2024-04-19 | |
| A2B Chem LLC | AG34358-25mg |
SUPININE |
551-58-6 | 98% by HPLC | 25mg |
$1942.00 | 2024-04-19 | |
| A2B Chem LLC | AG34358-50mg |
SUPININE |
551-58-6 | 98% by HPLC | 50mg |
$3283.00 | 2024-04-19 | |
| A2B Chem LLC | AG34358-100mg |
SUPININE |
551-58-6 | 98% by HPLC | 100mg |
$5652.00 | 2024-04-19 |
Supinine Related Literature
-
Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
-
Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
-
Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
-
Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
-
J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
551-58-6 (Supinine) Related Products
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- 10285-06-0((+)-Intermedine)
- 73544-48-6(Butanoic acid,2,3-dihydroxy-2-(1-methylethyl)-,[(1R,7aR)-1-(acetyloxy)-2,3,5,7a-tetrahydro-1H-pyrrolizin-7-yl]methyl ester,(2S,3S)-)
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