(3S)-6-Hydroxy-3-Methyl-8-[(2S,3R,4R,5R,6S)-3,4,5-Trihydroxy-6-Methyloxan-2-Yl]Oxy-3,4-Dihydro-2H-Benzo[a]Anthracene-1,7,12-Trione
[CAS# 137109-48-9]

Identification

• Name: (3S)-6-Hydroxy-3-Methyl-8-[(2S,3R,4R,5R,6S)-3,4,5-Trihydroxy-6-Methyloxan-2-Yl]Oxy-3,4-Dihydro-2H-Benzo[a]Anthracene-1,7,12-Trione
• Synonyms: (3S)-6-Hydroxy-3-Methyl-8-[(2S,3R,4R,5R,6S)-3,4,5-Trihydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-3,4-Dihydro-2H-Benzo[A]Anthracene-1,7,12-Trione; (3S)-6-Hydroxy-3-Methyl-8-[[(2S,3R,4R,5R,6S)-3,4,5-Trihydroxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-3,4-Dihydro-2H-Benzo[A]Anthracene-1,7,12-Trione; (3S)-6-Hydroxy-3-Methyl-8-[(2S,3R,4R,5R,6S)-3,4,5-Trihydroxy-6-Methyl-Oxan-2-Yl]Oxy-3,4-Dihydro-2H-Benzo[A]Anthracene-1,7,12-Trione
• Molecular Formula: C₂₅H₂₄O₉
• Molecular Weight: 468.46
• CAS Registry Number: 137109-48-9
• SMILES: [C@@H]5(OC1=CC=CC3=C1C(=O)C2=C(O)C=C4C(=C2C3=O)C(=O)C[C@H](C4)C)O[C@H]([C@H](O)[C@@H](O)[C@H]5O)C
• InChI: 1S/C25H24O9/c1-9-6-11-8-14(27)18-19(16(11)13(26)7-9)21(29)12-4-3-5-15(17(12)22(18)30)34-25-24(32)23(31)20(28)10(2)33-25/h3-5,8-10,20,23-25,27-28,31-32H,6-7H2,1-2H3/t9-,10-,20-,23+,24+,25-/m0/s1
• InChIKey: WEVSDLAMOJTGBF-JIOQQOEXSA-N

Properties

• Density: 1.514g/cm³ (Cal.)
• Boiling point: 793.169°C at 760 mmHg (Cal.)
• Flash point: 274.821°C (Cal.)