(S)-6,7-Dihydro-1,2,3-Trimethoxy-10-(Methylthio)-7-(2-O,3-O,4-O,6-O-Tetraacetyl-beta-D-Glucopyranosylamino)Benzo[a]Heptalen-9(5H)-One
[CAS# 66568-83-0]

Identification

• Name: (S)-6,7-Dihydro-1,2,3-Trimethoxy-10-(Methylthio)-7-(2-O,3-O,4-O,6-O-Tetraacetyl-beta-D-Glucopyranosylamino)Benzo[a]Heptalen-9(5H)-One
• Synonyms: [4,5-Diacetoxy-6-(Acetoxymethyl)-2-[[(7S)-1,2,3-Trimethoxy-10-Methylsulfanyl-9-Oxo-6,7-Dihydro-5H-Benzo[D]Heptalen-7-Yl]Amino]Tetrahydropyran-3-Yl] Acetate; Acetic Acid [4,5-Diacetoxy-6-(Acetoxymethyl)-2-[[(7S)-1,2,3-Trimethoxy-10-(Methylthio)-9-Oxo-6,7-Dihydro-5H-Benzo[D]Heptalen-7-Yl]Amino]-3-Tetrahydropyranyl] Ester; Acetic Acid [4,5-Diacetoxy-6-(Acetoxymethyl)-2-[[(7S)-9-Keto-1,2,3-Trimethoxy-10-(Methylthio)-6,7-Dihydro-5H-Benzo[D]Heptalen-7-Yl]Amino]Tetrahydropyran-3-Yl] Ester
• Molecular Formula: C₃₄H₄₁NO₁₃S
• Molecular Weight: 703.76
• CAS Registry Number: 66568-83-0
• SMILES: [C@H]2(C1=CC(C(=CC=C1C3=C(CC2)C=C(OC)C(=C3OC)OC)SC)=O)NC4OC(COC(C)=O)C(OC(C)=O)C(C4OC(=O)C)OC(C)=O
• InChI: 1S/C34H41NO13S/c1-16(36)44-15-26-30(45-17(2)37)32(46-18(3)38)33(47-19(4)39)34(48-26)35-23-11-9-20-13-25(41-5)29(42-6)31(43-7)28(20)21-10-12-27(49-8)24(40)14-22(21)23/h10,12-14,23,26,30,32-35H,9,11,15H2,1-8H3/t23-,26?,30?,32?,33?,34?/m0/s1
• InChIKey: DINYYSXLAGRWQI-SCAJORLVSA-N

Properties

• Density: 1.346g/cm³ (Cal.)
• Boiling point: 821.539°C at 760 mmHg (Cal.)
• Flash point: 450.651°C (Cal.)