Cefcanel Daloxate Hydrochloride
[CAS# 92602-21-6]

Identification

• Name: Cefcanel Daloxate Hydrochloride
• Synonyms: (5-Methyl-2-Oxo-1,3-Dioxol-4-Yl)Methyl (6R,7R)-7-[[(2R)-2-[(2S)-2-Aminopropanoyl]Oxy-2-Phenyl-Acetyl]Amino]-3-[(5-Methyl-1,3,4-Thiadiazol-2-Yl)Sulfanylmethyl]-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylate Hydrochloride; (6R,7R)-7-[[(2R)-2-[(2S)-2
• Molecular Formula: C₂₇H₂₈ClN₅O₉S₃
• Molecular Weight: 698.18
• CAS Registry Number: 92602-21-6
• SMILES: [C@H]12SCC(=C(N1C(=O)[C@H]2NC(=O)[C@H](OC(=O)[C@@H](N)C)C3=CC=CC=C3)C(OCC4=C(OC(O4)=O)C)=O)CSC5=NN=C(S5)C.[H+].[Cl-]
• InChI: 1S/C27H27N5O9S3.ClH/c1-12(28)24(35)41-20(15-7-5-4-6-8-15)21(33)29-18-22(34)32-19(25(36)38-9-17-13(2)39-27(37)40-17)16(10-42-23(18)32)11-43-26-31-30-14(3)44-26;/h4-8,12,18,20,23H,9-11,28H2,1-3H3,(H,29,33);1H/t12-,18+,20+,23+;/m0./s1
• InChIKey: HFVATKYQUGKLGL-PCQLZLFJSA-N

Properties

• Boiling point: 908.4°C at 760 mmHg (Cal.)
• Flash point: 503.2°C (Cal.)