Cas no 87619-88-3 (argipressin (5-9), (2-1')-disulfide Cys(6)-)
87619-88-3 structure
Product Name:argipressin (5-9), (2-1')-disulfide Cys(6)-
CAS No:87619-88-3
MF:C23H41N11O8S2
MW:663.770540952683
CID:992722
Update Time:2022-07-26
argipressin (5-9), (2-1')-disulfide Cys(6)- Chemical and Physical Properties
Names and Identifiers
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- argipressin (5-9), (2-1')-disulfide Cys(6)-
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- Inchi： 1S/C23H41N11O8S2/c24-11(7-16(26)35)18(37)33-14(10-44-43-9-12(25)22(41)42)21(40)34-6-2-4-15(34)20(39)32-13(3-1-5-30-23(28)29)19(38)31-8-17(27)36/h11-15H,1-10,24-25H2,(H2,26,35)(H2,27,36)(H,31,38)(H,32,39)(H,33,37)(H,41,42)(H4,28,29,30)/t11-,12-,13-,14-,15-/m0/s1
- InChI Key： CTUGLLVOLAMBDG-YTFOTSKYSA-N
- SMILES： C(N1CCC[C@H]1C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(=O)N)(=O)[C@H](CSSC[C@H](N)C(=O)O)NC(=O)[C@@H](N)CC(=O)N
Computed Properties
- Exact Mass: 389.089082
- Monoisotopic Mass: 389.089082
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 27
- Rotatable Bond Count: 5
- Complexity: 748
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 131
argipressin (5-9), (2-1')-disulfide Cys(6)- Related Literature
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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