Chemical Formula: | C26H34O7 |
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Molecular Weight: | 458.54 |
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Synonyms: | 1-oxaspiro(2,5)oct-6-ylester; 2,4,6,8-decatetraenedioicacid,mono[5-methoxy-4-[2-methyl-3-(3-methyl-2-buteny; 5beta,6beta(all-e)]]-theta; 6,8-decatetraenedioicacid,4-(1,2-epoxy-1,5-dimethyl-4-hexenyl)-5-methoxy-4; amebacillin; fugilin; fumidil; h-3 |
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MDL No.: | MFCD03990453 |
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EINECS / EC No.: | 245-433-8 |
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Pubchem CID: | 6917655 |
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IUPAC Name: | (2E,4E,6E,8E)-10-[[(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl]oxy]-10-oxodeca-2,4,6,8-tetraenoic acid |
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Standard InchI: | InChI=1S/C26H34O7/c1-18(2)13-14-20-25(3,33-20)24-23(30-4)19(15-16-26(24)17-31-26)32-22(29)12-10-8-6-5-7-9-11-21(27)28/h5-13,19-20,23-24H,14-17H2,1-4H3,(H,27,28)/b7-5+,8-6+,11-9+,12-10+/t19-,20-,23-,24-,25+,26+/m1/s1 |
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InchI Key: | NGGMYCMLYOUNGM-CSDLUJIJSA-N |
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SMILES: | CC(=CCC1C(O1)(C)C2C(C(CCC23CO3)OC(=O)C=CC=CC=CC=CC(=O)O)OC)C |
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Appearance: | white powder |
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Melting Point: | 194-195 °C |
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Boiling Point: | 484.03 °C (rough estimate) |
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Density (Theoretical): | 1.1368 (rough estimate) |
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Solubility: | ethanol: 1 mg/mL |
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Refractive Index: | 1.5800 (estimate) |
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