(2E,4E,6E)-7-[3-hydroxy-5-[(4E,6E)-3-methoxy-4-methyl-8-[2-[2,4,5-trihydroxy-5-methyl-6-[(1E,3E)-penta-1,3-dienyl]oxan-2-yl]butanoylamino]octa-4,6-dien-2-yl]oxolan-2-yl]hepta-2,4,6-trienoic acid
[CAS# 93522-10-2]

Identification

• Name: (2E,4E,6E)-7-[3-hydroxy-5-[(4E,6E)-3-methoxy-4-methyl-8-[2-[2,4,5-trihydroxy-5-methyl-6-[(1E,3E)-penta-1,3-dienyl]oxan-2-yl]butanoylamino]octa-4,6-dien-2-yl]oxolan-2-yl]hepta-2,4,6-trienoic acid
• Synonyms: (2E,4E,6E)-7-[3-Hydroxy-5-[(3E,5E)-2-Methoxy-1,3-Dimethyl-7-[2-[2,4,5-Trihydroxy-5-Methyl-6-[(1E,3E)-Penta-1,3-Dienyl]Tetrahydropyran-2-Yl]Butanoylamino]Hepta-3,5-Dienyl]Tetrahydrofuran-2-Yl]Hepta-2,4,6-Trienoic Acid; (2E,4E,6E)-7-[3-Hydroxy-5-[(3E,5E)-2-M
• Molecular Formula: C₃₆H₅₃NO₁₀
• Molecular Weight: 659.82
• CAS Registry Number: 93522-10-2
• SMILES: C(C(C1(OC(C(O)(C(O)C1)C)\C=C\C=C\C)O)C(=O)NC\C=C\C=C(C(OC)C(C2OC(C(O)C2)\C=C\C=C\C=C\C(=O)O)C)/C)C
• InChI: 1S/C36H53NO10/c1-7-9-12-19-31-35(5,43)30(39)23-36(44,47-31)26(8-2)34(42)37-21-16-15-17-24(3)33(45-6)25(4)29-22-27(38)28(46-29)18-13-10-11-14-20-32(40)41/h7,9-20,25-31,33,38-39,43-44H,8,21-23H2,1-6H3,(H,37,42)(H,40,41)/b9-7+,11-10+,16-15+,18-13+,19-12+,20-
• InChIKey: OSKAZZUZQORABG-UQKUNJBPSA-N

Properties

• Density: 1.231g/cm³ (Cal.)
• Boiling point: 853.372°C at 760 mmHg (Cal.)
• Flash point: 469.902°C (Cal.)