Cas no 391866-99-2 (Glutamic acid, N-[3-[(1-oxooctadecyl)(2-sulfoethyl)amino]propyl]-)
![Glutamic acid, N-[3-[(1-oxooctadecyl)(2-sulfoethyl)amino]propyl]- structure](https://ossimg.kuujia.com/scimg/392000/391866-99-2x500.png)
391866-99-2 structure
Product Name:Glutamic acid, N-[3-[(1-oxooctadecyl)(2-sulfoethyl)amino]propyl]-
CAS No:391866-99-2
MF:C28H54N2O8S
MW:578.801968097687
CID:1501821
PubChem ID:85804854
Update Time:2025-04-21
Glutamic acid, N-[3-[(1-oxooctadecyl)(2-sulfoethyl)amino]propyl]- Chemical and Physical Properties
Names and Identifiers
-
- Glutamic acid, N-[3-[(1-oxooctadecyl)(2-sulfoethyl)amino]propyl]-
- (3-(N-(2-Sulfoethyl)stearamido)propyl)-DL-glutamic acid
- 391866-99-2
-
- Inchi： 1S/C28H54N2O8S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-26(31)30(23-24-39(36,37)38)22-17-21-29-25(28(34)35)19-20-27(32)33/h25,29H,2-24H2,1H3,(H,32,33)(H,34,35)(H,36,37,38)
- InChI Key： BTOYCSSHMFRSEH-UHFFFAOYSA-N
- SMILES： S(CCN(C(CCCCCCCCCCCCCCCCC)=O)CCCNC(C(=O)O)CCC(=O)O)(=O)(=O)O
Computed Properties
- Exact Mass: 578.36032
- Monoisotopic Mass: 578.36008786g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 9
- Heavy Atom Count: 39
- Rotatable Bond Count: 28
- Complexity: 755
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.2
- Topological Polar Surface Area: 170?2
Experimental Properties
- PSA: 161.31
Glutamic acid, N-[3-[(1-oxooctadecyl)(2-sulfoethyl)amino]propyl]- Related Literature
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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