Cas no 1616757-59-5 (Caesalpine A)
Caesalpine A structure
Product Name:Caesalpine A
CAS No:1616757-59-5
MF:C23H32O7
MW:420.495987892151
CID:3164738
PubChem ID:124708210
Update Time:2025-09-22
Caesalpine A Chemical and Physical Properties
Names and Identifiers
-
- Caesalpine A
- HY-133225
- Methyl (1S,4aR,6S,6aR,7S,11aS,11bS)-6-acetyloxy-1,4a-dihydroxy-4,4,11b-trimethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-7-carboxylate
- 1616757-59-5
- AKOS040761443
- CS-0113481
- DA-61995
-
- Inchi： 1S/C23H32O7/c1-12(24)30-16-11-23(27)21(2,3)8-6-17(25)22(23,4)14-10-15-13(7-9-29-15)18(19(14)16)20(26)28-5/h7,9,14,16-19,25,27H,6,8,10-11H2,1-5H3/t14-,16-,17-,18+,19-,22-,23+/m0/s1
- InChI Key： UQNOSWRXLARWGA-PYMXQXNBSA-N
- SMILES： O[C@@]12C[C@@H]([C@H]3[C@H](C(=O)OC)C4C=COC=4C[C@@H]3[C@@]1(C)[C@H](CCC2(C)C)O)OC(C)=O
Computed Properties
- Exact Mass: 420.21480336g/mol
- Monoisotopic Mass: 420.21480336g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 30
- Rotatable Bond Count: 4
- Complexity: 720
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 7
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.4
- Topological Polar Surface Area: 106?2
Experimental Properties
- Color/Form: Powder
- Density: 1.3±0.1 g/cm3
- Boiling Point: 515.8±50.0 °C at 760 mmHg
- Flash Point: 265.8±30.1 °C
- Vapor Pressure: 0.0±1.4 mmHg at 25°C
Caesalpine A Security Information
- Hazard Statement： H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
- Warning Statement： P264+P280+P305+P351+P338+P337+P313
- Safety Instruction： H303+H313+H333
- Storage Condition：Store at 4 ℃, better at -4 ℃
Caesalpine A Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI TAO SHU Biotechnology Co., Ltd. | TN3565-1 mg |
Caesalpine A |
1616757-59-5 | 1mg |
￥3635.00 | 2022-04-26 | ||
| TargetMol Chemicals | TN3565-5mg |
Caesalpine A |
1616757-59-5 | 5mg |
￥ 5130 | 2024-07-20 | ||
| TargetMol Chemicals | TN3565-5 mg |
Caesalpine A |
1616757-59-5 | 98% | 5mg |
￥ 5,130 | 2023-07-11 | |
| TargetMol Chemicals | TN3565-1 mL * 10 mM (in DMSO) |
Caesalpine A |
1616757-59-5 | 98% | 1 mL * 10 mM (in DMSO) |
￥ 5230 | 2023-09-15 | |
| TargetMol Chemicals | TN3565-1 ml * 10 mm |
Caesalpine A |
1616757-59-5 | 1 ml * 10 mm |
￥ 5230 | 2024-07-20 |
Caesalpine A Related Literature
-
Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
-
Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
-
Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
-
Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
-
Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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