Proctosedyl ointment
[CAS# 8058-05-7]

Identification

• Name: Proctosedyl ointment
• Synonyms: (2R,3S,4R,5R,6R)-5-Amino-2-(Aminomethyl)-6-[(1R,2R,3S,4R,6S)-4,6-Diamino-2-[(2S,3R,4S,5R)-4-[(2R,3R,4R,5S,6S)-3-Amino-6-(Aminomethyl)-4,5-Dihydroxy-Tetrahydropyran-2-Yl]Oxy-3-Hydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Yl]Oxy-3-Hydroxy-Cyclohexoxy]Tetrahydropyran-3,4-Diol; 2-Butoxy-N-(2-Diethylaminoethyl)Quinoline-4-Carboxamide; (8S,9S,10R,11S,13S,14S,17R)-11,17-Dihydroxy-17-(2-Hydroxyacetyl)-10,13-Dimethyl-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthren-3-One; (2R,3S,4R,5R,6R)-5-Amino-2-(Aminomethyl)-6-[(1R,2R,3S,4R,6S)-4,6-Diamino-2-[[(2S,3R,4S,5R)-4-[[(2R,3R,4R,5S,6S)-3-Amino-6-(Aminomethyl)-4,5-Dihydroxy-2-Tetrahydropyranyl]Oxy]-3-Hydroxy-5-(Hydroxymethyl)-2-Tetrahydrofuranyl]Oxy]-3-Hydroxycyclohexoxy]Tetrahydropyran-3,4-Diol; 2-Butoxy-N-(2-Diethylaminoethyl)-4-Quinolinecarboxamide; (8S,9S,10R,11S,13S,14S,17R)-11,17-Dihydroxy-17-(2-Hydroxy-1-Oxoethyl)-10,13-Dimethyl-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthren-3-One
• Molecular Formula: C₆₄H₁₀₅N₉O₂₀
• Molecular Weight: 1320.58
• CAS Registry Number: 8058-05-7
• SMILES: [C@H]34[C@H]2[C@@H]([C@@]1(C(=CC(=O)CC1)CC2)C)[C@@H](O)C[C@@]3([C@](O)(CC4)C(=O)CO)C.[C@@H]8(O[C@H]6[C@H](O[C@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5N)CN)[C@@H](N)C[C@@H](N)[C@@H]6O)O[C@@H]([C@@H](O[C@H]7O[C@H]([C@@H](O)[C@H](O)[C@H]7N)CN)[C@H]8O)CO.C(OC9=CC(=C%10C(=N9)C=CC=C%10)C(=O)NCCN(CC)CC)CCC
• InChI: 1S/C23H46N6O13.C21H30O5.C20H29N3O2/c24-2-7-13(32)15(34)10(28)21(37-7)40-18-6(27)1-5(26)12(31)20(18)42-23-17(36)19(9(4-30)39-23)41-22-11(29)16(35)14(33)8(3-25)38-22;1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19;1-4-7-14-25-19-15-17(16-10-8-9-11-18(16)22-19)20(24)21-12-13-23(5-2)6-3/h5-23,30-36H,1-4,24-29H2;9,14-16,18,22,24,26H,3-8,10-11H2,1-2H3;8-11,15H,4-7,12-14H2,1-3H3,(H,21,24)/t5-,6+,7-,8+,9-,10-,11-,12+,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23+;14-,15-,16-,18+,19-,20-,21-;/m10./s1
• InChIKey: AZXZMCQMDWVCDF-SCEXVKQTSA-N

Properties

• Boiling point: 927.1°C at 760 mmHg (Cal.)
• Flash point: 514.5°C (Cal.)