quinolidomicin A1
[CAS# 148504-47-6]

Identification

• Name: quinolidomicin A1
• Synonyms: quinolidomicin A1
• Molecular Formula: C₈₃H₁₃₂O₂₃S
• Molecular Weight: 1529.99
• CAS Registry Number: 148504-47-6
• SMILES: CC(CCC(OC)C=1C(=O)C(\O)=C/C(=O)C=1SC)/C=C/C=C/C3OC(=O)CC2(O)CC(O)C(C)C(O2)C(C)C(O)C(C)/C=C\C=C(/C)C(O)C(C)C(O)CC(O)C(C)CCC(O)CC(O)CC(O)\C=C\C=C\CC(O)CC(=O)CC(O)\C=C\C=C\C=C\CC(O)CC(O)CCC(C)CCCCC(O)CC(O)C3
• InChI: 1S/C83H132O23S/c1-51-24-19-21-32-63(88)44-68(93)46-69(33-22-20-25-52(2)35-39-75(104-9)77-80(102)72(96)48-73(97)82(77)107-10)105-76(99)50-83(103)49-74(98)57(7)81(106-83)58(8)79(101)55(5)27-23-26-54(4)78(100)56(6)71(95)47-70(94)53(3)36-38-65(90)45-67(92)43-62(87)31-18-14-17-30-61(86)42-66(91)41-60(85)29-16-13-11-12-15-28-59(84)40-64(89)37-34-51/h11-18,20,22-23,25-27,29,31,33,48,51-53,55-65,67-71,74-75,78-79,81,84-90,92-96,98,100-101,103H,19,21,24,28,30,32,34-47,49-50H2,1-10H3/b13-11+,15-12+,17-14+,25-20+,27-23-,29-16+,31-18+,33-22+,54-26+
• InChIKey: ICRSVVBHIOAZHM-HNLUZOLXSA-N

Properties

• Density: 1.253g/cm³ (Cal.)
• Boiling point: 1444.596°C at 760 mmHg (Cal.)
• Flash point: 827.462°C (Cal.)
• Refractive index: 1.597 (Cal.)