2-N-(4-Benzoyl)Benzoyl-1,3-Bis(Mannos-4-Yloxy)-2-Propylamine
[CAS# 119188-97-5]

Identification

• Name: 2-N-(4-Benzoyl)Benzoyl-1,3-Bis(Mannos-4-Yloxy)-2-Propylamine
• Synonyms: 4-(Benzoyl)-N-[2-[(1R,2R,3S)-1-[(1R)-1,2-Dihydroxyethyl]-2,3-Dihydroxy-4-Oxo-Butoxy]-1-[[(1R,2R,3S)-1-[(1R)-1,2-Dihydroxyethyl]-2,3-Dihydroxy-4-Oxo-Butoxy]Methyl]-1-Tritio-Ethyl]-N-Tritio-Benzamide; N-[2-[(1R,2R,3S)-1-[(1R)-1,2-Dihydroxyethyl]-2,3-Dihydroxy-4-Oxobutoxy]-1-[[(1R,2R,3S)-1-[(1R)-1,2-Dihydroxyethyl]-2,3-Dihydroxy-4-Oxobutoxy]Methyl]-1-Tritioethyl]-4-(Oxo-Phenylmethyl)-N-Tritiobenzamide; 4-(Benzoyl)-N-[2-[(1R,2R,3S)-1-[(1R)-1,2-Dihydroxyethyl]-2,3-Dihydroxy-4-Keto-Butoxy]-1-[[(1R,2R,3S)-1-[(1R)-1,2-Dihydroxyethyl]-2,3-Dihydroxy-4-Keto-Butoxy]Methyl]-1-Tritio-Ethyl]-N-Tritio-Benzamide
• Molecular Formula: C₂₉H₃₅T₂NO₁₄
• Molecular Weight: 627.63
• CAS Registry Number: 119188-97-5
• SMILES: [C@H](C=O)(O)[C@@H](O)[C@H](OCC(CO[C@@H]([C@@H]([C@@H](C=O)O)O)[C@H](O)CO)([3H])N(C(C1=CC=C(C=C1)C(C2=CC=CC=C2)=O)=O)[3H])[C@H](O)CO
• InChI: 1S/C29H37NO14/c31-10-20(35)25(40)27(22(37)12-33)43-14-19(15-44-28(23(38)13-34)26(41)21(36)11-32)30-29(42)18-8-6-17(7-9-18)24(39)16-4-2-1-3-5-16/h1-11,19-23,25-28,33-38,40-41H,12-15H2,(H,30,42)/t20-,21-,22-,23-,25-,26-,27-,28-/m1/s1/i19T/hT
• InChIKey: BSTDRJRJBYFKIU-IOOKBIAFSA-N

Properties

• Boiling point: 988.866°C at 760 mmHg (Cal.)
• Flash point: 551.846°C (Cal.)