Sibiromycin
[CAS# 12684-33-2]

Identification

• Name: Sibiromycin
• Synonyms: (6R,6As)-2-[(2S,3R,4R,5S,6S)-3,4-Dihydroxy-4,6-Dimethyl-5-Methylamino-Tetrahydropyran-2-Yl]Oxy-4,6-Dihydroxy-3-Methyl-8-[(E)-Prop-1-Enyl]-5,6,6A,7-Tetrahydropyrrolo[2,1-C][1,4]Benzodiazepin-11-One; (6R,6As)-2-[[(2S,3R,4R,5S,6S)-3,4-Dihydroxy-4,6-Dimethyl-5-Methylamino-2-Tetrahydropyranyl]Oxy]-4,6-Dihydroxy-3-Methyl-8-[(E)-Prop-1-Enyl]-5,6,6A,7-Tetrahydropyrrolo[2,1-C][1,4]Benzodiazepin-11-One; (6R,6As)-2-[(2S,3R,4R,5S,6S)-3,4-Dihydroxy-4,6-Dimethyl-5-Methylamino-Oxan-2-Yl]Oxy-4,6-Dihydroxy-3-Methyl-8-[(E)-Prop-1-Enyl]-5,6,6A,7-Tetrahydropyrrolo[2,1-C][1,4]Benzodiazepin-11-One
• Molecular Formula: C₂₄H₃₃N₃O₇
• Molecular Weight: 475.54
• CAS Registry Number: 12684-33-2
• SMILES: [C@@H]24N(C(=O)C1=CC(=C(C(=C1N[C@@H]2O)O)C)O[C@@H]3O[C@H]([C@H](NC)[C@@](O)([C@H]3O)C)C)C=C(C4)\C=C\C
• InChI: 1S/C24H33N3O7/c1-6-7-13-8-15-21(30)26-17-14(22(31)27(15)10-13)9-16(11(2)18(17)28)34-23-20(29)24(4,32)19(25-5)12(3)33-23/h6-7,9-10,12,15,19-21,23,25-26,28-30,32H,8H2,1-5H3/b7-6+/t12-,15-,19-,20-,21+,23-,24+/m0/s1
• InChIKey: RAGFPHFDFVNLCG-INYQBOQCSA-N

Properties

• Density: 1.415g/cm³ (Cal.)
• Boiling point: 755.728°C at 760 mmHg (Cal.)
• Flash point: 410.85°C (Cal.)