[2-[4-(4-Amino-5-Hydroxy-6-Methyloxan-2-Yl)Oxy-2,5,7,12-Tetrahydroxy-6,11-Dioxo-3,4-Dihydro-1H-Tetracen-2-Yl]-2-Oxoethyl] 2-Hydroxybenzoate
[CAS# 116907-26-7]

Identification

• Name: [2-[4-(4-Amino-5-Hydroxy-6-Methyloxan-2-Yl)Oxy-2,5,7,12-Tetrahydroxy-6,11-Dioxo-3,4-Dihydro-1H-Tetracen-2-Yl]-2-Oxoethyl] 2-Hydroxybenzoate
• Synonyms: [2-[4-(4-Amino-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl)Oxy-2,5,7,12-Tetrahydroxy-6,11-Dioxo-3,4-Dihydro-1H-Tetracen-2-Yl]-2-Oxo-Ethyl] 2-Hydroxybenzoate; 2-Hydroxybenzoic Acid [2-[4-[(4-Amino-5-Hydroxy-6-Methyl-2-Tetrahydropyranyl)Oxy]-2,5,7,12-Tetrahydroxy-6,11-Dioxo-3,4-Dihydro-1H-Tetracen-2-Yl]-2-Oxoethyl] Ester; 2-Hydroxybenzoic Acid [2-[4-(4-Amino-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl)Oxy-2,5,7,12-Tetrahydroxy-6,11-Diketo-3,4-Dihydro-1H-Tetracen-2-Yl]-2-Keto-Ethyl] Ester
• Molecular Formula: C₃₃H₃₁NO₁₃
• Molecular Weight: 649.61
• CAS Registry Number: 116907-26-7
• SMILES: C6=C5C(=O)C1=C(C(=C2C(=C1O)CC(O)(CC2OC3OC(C(O)C(N)C3)C)C(=O)COC(=O)C4=C(O)C=CC=C4)O)C(=O)C5=C(O)C=C6
• InChI: 1S/C33H31NO13/c1-13-27(38)17(34)9-22(46-13)47-20-11-33(44,21(37)12-45-32(43)14-5-2-3-7-18(14)35)10-16-24(20)31(42)26-25(29(16)40)28(39)15-6-4-8-19(36)23(15)30(26)41/h2-8,13,17,20,22,27,35-36,38,40,42,44H,9-12,34H2,1H3
• InChIKey: AJAHDRMPRTTZMX-UHFFFAOYSA-N

Properties

• Density: 1.674g/cm³ (Cal.)
• Boiling point: 877.581°C at 760 mmHg (Cal.)
• Flash point: 484.543°C (Cal.)