Cas no 108908-53-8 (5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[(2-amino-4-thiazolyl)[[2-(1,1-dimethylethoxy)-2-oxoethoxy]imino]acetyl]amino]-3-ethenyl-8-oxo-, diphenylmethyl ester, [6R-[6α,7β(E)]]-)
![5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[(2-amino-4-thiazolyl)[[2-(1,1-dimethylethoxy)-2-oxoethoxy]imino]acetyl]amino]-3-ethenyl-8-oxo-, diphenylmethyl ester, [6R-[6α,7β(E)]]- structure](https://ossimg.kuujia.com/scimg/109000/108908-53-8x500.png)
108908-53-8 structure
Product Name:5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[(2-amino-4-thiazolyl)[[2-(1,1-dimethylethoxy)-2-oxoethoxy]imino]acetyl]amino]-3-ethenyl-8-oxo-, diphenylmethyl ester, [6R-[6α,7β(E)]]-
CAS No:108908-53-8
MF:C33H33N5O7S2
MW:675.774425268173
CID:5616184
Update Time:2024-02-03
5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[(2-amino-4-thiazolyl)[[2-(1,1-dimethylethoxy)-2-oxoethoxy]imino]acetyl]amino]-3-ethenyl-8-oxo-, diphenylmethyl ester, [6R-[6α,7β(E)]]- Chemical and Physical Properties
Names and Identifiers
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- 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[(2-amino-4-thiazolyl)[[2-(1,1-dimethylethoxy)-2-oxoethoxy]imino]acetyl]amino]-3-ethenyl-8-oxo-, diphenylmethyl ester, [6R-[6α,7β(E)]]-
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- Inchi： 1S/C33H33N5O7S2/c1-5-19-17-46-30-25(36-28(40)24(22-18-47-32(34)35-22)37-43-16-23(39)45-33(2,3)4)29(41)38(30)26(19)31(42)44-27(20-12-8-6-9-13-20)21-14-10-7-11-15-21/h5-15,18,25,27,30H,1,16-17H2,2-4H3,(H2,34,35)(H,36,40)/b37-24+/t25-,30-/m1/s1
- InChI Key： JRFZIKQVFZKSDR-DFBLZAPXSA-N
- SMILES： N12[C@@]([H])([C@H](NC(/C(/C3=CSC(N)=N3)=N/OCC(OC(C)(C)C)=O)=O)C1=O)SCC(C=C)=C2C(OC(C1=CC=CC=C1)C1=CC=CC=C1)=O
Experimental Properties
- Density: 1.40±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)
- pka: 7.81±0.60(Predicted)
5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[(2-amino-4-thiazolyl)[[2-(1,1-dimethylethoxy)-2-oxoethoxy]imino]acetyl]amino]-3-ethenyl-8-oxo-, diphenylmethyl ester, [6R-[6α,7β(E)]]- Related Literature
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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