Antibiotic SF 2487 sodium salt
[CAS# 120203-60-3]

Identification

• Name: Antibiotic SF 2487 sodium salt
• Synonyms: 3-[(2S)-2-[(1R,2R,3R,4R,6R)-3-Hydroxy-6-[(E)-3-Hydroxy-2-[(2R,5S,6S)-6-[(E)-3-[(2S,3R,5S)-5-[(2R,5S)-5-[(1R)-1-Hydroxypropyl]Tetrahydrofuran-2-Yl]-3,5-Dimethyl-Tetrahydrofuran-2-Yl]-1-Methyl-Prop-1-Enyl]-5-Methyl-Tetrahydropyran-2-Yl]Prop-1-Enyl]-2-(Hydroxymethyl)-4-Methyl-Cyclohexyl]-2-Methoxy-Acetyl]-5-Methylene-Tetrahydrofuran-2,4-Dione; Sodium; 3-[(2S)-2-[(1R,2R,3R,4R,6R)-3-Hydroxy-6-[(E)-3-Hydroxy-2-[(2R,5S,6S)-6-[(E)-3-[(2S,3R,5S)-5-[(2R,5S)-5-[(1R)-1-Hydroxypropyl]-2-Tetrahydrofuranyl]-3,5-Dimethyl-2-Tetrahydrofuranyl]-1-Methylprop-1-Enyl]-5-Methyl-2-Tetrahydropyranyl]Prop-1-Enyl]-2-(Hydroxymethyl)-4-Methylcyclohexyl]-2-Methoxy-1-Oxoethyl]-5-Methylenetetrahydrofuran-2,4-Dione; Sodium; 3-[(2S)-2-[(1R,2R,3R,4R,6R)-3-Hydroxy-6-[(E)-3-Hydroxy-2-[(2R,5S,6S)-6-[(E)-3-[(2S,3R,5S)-5-[(2R,5S)-5-[(1R)-1-Hydroxypropyl]Tetrahydrofuran-2-Yl]-3,5-Dimethyl-Tetrahydrofuran-2-Yl]-1-Methyl-Prop-1-Enyl]-5-Methyl-Tetrahydropyran-2-Yl]Prop-1-Enyl]-4-Methyl-2-Methylol-Cyclohexyl]-2-Methoxy-Acetyl]-5-Methylene-Tetrahydrofuran-2,4-Quinone; Sodium
• Molecular Formula: C₄₂H₆₄NaO₁₂
• Molecular Weight: 783.95
• CAS Registry Number: 120203-60-3
• SMILES: [Na].[C@H]1(O[C@@H](CC1)[C@H](O)CC)[C@]2(O[C@H]([C@@H](C2)C)C\C=C(\[C@H]5O[C@@H](/C(=C/[C@@H]4[C@@H]([C@H](OC)C(=O)C3C(=O)C(OC3=O)=C)[C@@H]([C@H](O)[C@@H](C4)C)CO)CO)CC[C@@H]5C)C)C
• InChI: 1S/C42H64O12.Na/c1-9-29(45)32-14-15-33(52-32)42(7)18-24(5)30(54-42)12-10-21(2)39-22(3)11-13-31(53-39)27(19-43)17-26-16-23(4)36(46)28(20-44)34(26)40(50-8)38(48)35-37(47)25(6)51-41(35)49;/h10,17,22-24,26,28-36,39-40,43-46H,6,9,11-16,18-20H2,1-5,7-8H3;/b21-10+,27-17+;/t22-,23+,24+,26+,28-,29+,30-,31+,32-,33+,34+,35?,36+,39+,40-,42-;/m0./s1
• InChIKey: JINRBYOWHJLDLT-FYJCAEPUSA-N