(7S,9S)-6,9,11-Trihydroxy-9-(2-Hydroxyacetyl)-7-[(2R,4S,6R)-4-Hydroxy-6-Methyloxan-2-Yl]Oxy-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione
[CAS# 130592-19-7]

Identification

• Name: (7S,9S)-6,9,11-Trihydroxy-9-(2-Hydroxyacetyl)-7-[(2R,4S,6R)-4-Hydroxy-6-Methyloxan-2-Yl]Oxy-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione
• Synonyms: (7S,9S)-6,9,11-Trihydroxy-9-(2-Hydroxyacetyl)-7-[(2R,4S,6R)-4-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; (7S,9S)-6,9,11-Trihydroxy-7-[[(2R,4S,6R)-4-Hydroxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-9-(2-Hydroxy-1-Oxoethyl)-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; (7S,9S)-9-Glycoloyl-6,9,11-Trihydroxy-7-[(2R,4S,6R)-4-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-4-Methoxy-8,10-Dihydro-7H-Tetracene-5,12-Quinone
• Molecular Formula: C₂₇H₂₈O₁₁
• Molecular Weight: 528.51
• CAS Registry Number: 130592-19-7
• SMILES: [C@@H]3(O[C@H]1O[C@@H](C[C@H](O)C1)C)C2=C(O)C5=C(C(=C2C[C@](O)(C3)C(=O)CO)O)C(=O)C4=CC=CC(=C4C5=O)OC
• InChI: 1S/C27H28O11/c1-11-6-12(29)7-18(37-11)38-16-9-27(35,17(30)10-28)8-14-20(16)26(34)22-21(24(14)32)23(31)13-4-3-5-15(36-2)19(13)25(22)33/h3-5,11-12,16,18,28-29,32,34-35H,6-10H2,1-2H3/t11-,12+,16+,18-,27+/m1/s1
• InChIKey: TZBDURDLNXOXBK-HWDYCMBPSA-N

Properties

• Density: 1.589g/cm³ (Cal.)
• Boiling point: 794.583°C at 760 mmHg (Cal.)
• Flash point: 267.429°C (Cal.)