Cas no 168111-98-6 (L-Tryptophan, N-acetyl-4-nitro-)
168111-98-6 structure
Product Name:L-Tryptophan, N-acetyl-4-nitro-
CAS No:168111-98-6
MF:C13H13N3O5
MW:291.259423017502
CID:3809385
PubChem ID:86183174
Update Time:2025-04-22
L-Tryptophan, N-acetyl-4-nitro- Chemical and Physical Properties
Names and Identifiers
-
- L-Tryptophan, N-acetyl-4-nitro-
- SCHEMBL20571244
- N-Acetyl-4-nitro-L-tryptophan
- N-Acetyl-4-nitro-DL-tryptophan
- SY308800
- 168111-98-6
- SY301166
-
- Inchi： 1S/C13H13N3O5/c1-7(17)15-10(13(18)19)5-8-6-14-9-3-2-4-11(12(8)9)16(20)21/h2-4,6,10,14H,5H2,1H3,(H,15,17)(H,18,19)
- InChI Key： PPBXRRAOLBQTEB-UHFFFAOYSA-N
- SMILES： OC(C(CC1=CNC2C=CC=C(C1=2)[N+](=O)[O-])NC(C)=O)=O
Computed Properties
- Exact Mass: 291.08552052g/mol
- Monoisotopic Mass: 291.08552052g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 21
- Rotatable Bond Count: 4
- Complexity: 436
- 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: 1.2
- Topological Polar Surface Area: 128?2
L-Tryptophan, N-acetyl-4-nitro- Related Literature
-
Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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