Cas no 78088-46-7 (L-Lysinamide,6-carboxy-N6-[N-(1-oxododecyl)-L-alanyl-D-g-glutamyl]-, (6S)- (9CI))
78088-46-7 structure
Product Name:L-Lysinamide,6-carboxy-N6-[N-(1-oxododecyl)-L-alanyl-D-g-glutamyl]-, (6S)- (9CI)
CAS No:78088-46-7
MF:C27H49N5O8
MW:571.706667661667
CID:570619
PubChem ID:3086083
Update Time:2025-04-19
L-Lysinamide,6-carboxy-N6-[N-(1-oxododecyl)-L-alanyl-D-g-glutamyl]-, (6S)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- L-Lysinamide,6-carboxy-N6-[N-(1-oxododecyl)-L-alanyl-D-g-glutamyl]-, (6S)- (9CI)
- (2S,6S)-6,7-diamino-2-[[(4R)-4-carboxy-4-[[(2S)-2-(dodecanoylamino)propanoyl]amino]butanoyl]amino]-7-oxoheptanoic acid
- TABILAUTIDE
- (2S,6S)-6,7-diamino-2-[[(4R)-4-[[(2S)-2-(dodecanoylamino)propanoyl]amino]-5-hydroxy-5-oxopentanoyl]amino]-7-oxoheptanoic acid
- Tabilautide [INN]
- UNII-EZ61NB05TG
- SCHEMBL446062
- 78088-46-7
- CHEMBL3989637
- EZ61NB05TG
- threo-6-Carbamoyl-N(sup 2)-(N-(N-lauroyl-L-alanyl)-D-gamma-glutamyl)-L-lysine
- Q15634101
- NS00125501
- DTXSID00228722
-
- Inchi: 1S/C27H49N5O8/c1-3-4-5-6-7-8-9-10-11-15-22(33)30-18(2)25(36)32-21(27(39)40)16-17-23(34)31-20(26(37)38)14-12-13-19(28)24(29)35/h18-21H,3-17,28H2,1-2H3,(H2,29,35)(H,30,33)(H,31,34)(H,32,36)(H,37,38)(H,39,40)/t18-,19-,20-,21+/m0/s1
- InChI Key: TUNXCNXMSJZNPO-XSDIEEQYSA-N
- SMILES: O=C(CCCCCCCCCCC)N[C@@H](C)C(N[C@@H](C(=O)O)CCC(N[C@H](C(=O)O)CCC[C@@H](C(N)=O)N)=O)=O
Computed Properties
- Exact Mass: 571.35800
- Monoisotopic Mass: 571.35811354g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 7
- Hydrogen Bond Acceptor Count: 9
- Heavy Atom Count: 40
- Rotatable Bond Count: 24
- Complexity: 823
- 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: 0.1
- Topological Polar Surface Area: 231?2
Experimental Properties
- PSA: 231.01000
- LogP: 3.88720
L-Lysinamide,6-carboxy-N6-[N-(1-oxododecyl)-L-alanyl-D-g-glutamyl]-, (6S)- (9CI) Related Literature
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
-
Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
-
Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
-
David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
78088-46-7 (L-Lysinamide,6-carboxy-N6-[N-(1-oxododecyl)-L-alanyl-D-g-glutamyl]-, (6S)- (9CI)) Related Products
- 14857-82-0(Gly-gly-leu)
- 3303-34-2(L-Alanyl-L-leucine)
- 13485-59-1(L-Alanyl-L-proline)
- 869-19-2(Glycyl-L-leucine)
- 25988-63-0(Poly-L-lysine hydrobromide (MW 150000-300000))
- 35305-74-9(N-Acetyl-L-glutamine)
- 52315-75-0(N-Lauroyl-L-lysine)
- 13115-71-4(Glycyl-glutamine)
- 2490-97-3(Aceglutamide)
- 39537-23-0(L-Alanyl-L-Glutamine)
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