| product Name |
Obacunone |
| CAS No |
751-03-1 |
| Synonyms |
AI3-37934; CCRIS 8657; Obacunoic acid, eta-lactone; Oxireno(4,4a)-2-benzopyrano(6,5-g)(2)benzoxepin-3,5,9(3aH,4bH,6H)-trione, 1-(3-furanyl)-1,6a,7,11a,11b,12,13,13a-octahydro-4b,7,7,11a,13a-pentamethyl-, (1S,3aS,4aR,4bR,6aR,11aR,11bR,11bR,13aS)-; (5aR,5bR,7aS,8R,10aS,11aR,11bR,13aR)-8-(furan-3-yl)-1,1,5a,7a,11b-pentamethyl-5b,6,7,7a,8,11b,13,13a-octahydrooxireno[4,4a]isochromeno[6,5-g][2]benzoxepine-3,10,12(1H,5aH,10aH)-trione; (5aR,7aS,8R,10aS,11aR,11bR)-8-(furan-3-yl)-12,12-dihydroxy-1,1,5a,7a,11b-pentamethyl-5a,5b,6,7,7a,8,11b,12,13,13a-decahydrooxireno[4,4a]isochromeno[6,5-g][2]benzoxepine-3,10(1H,10aH)-dione; Obacunon |
| Molecular Formula |
C26H32O8 |
| Molecular Weight |
472.5275 |
| InChI |
InChI=1/C26H32O8/c1-21(2)16-12-25(29,30)24(5)15(22(16,3)9-7-17(27)33-21)6-10-23(4)18(14-8-11-31-13-14)32-20(28)19-26(23,24)34-19/h7-9,11,13,15-16,18-19,29-30H,6,10,12H2,1-5H3/t15?,16?,18-,19+,22+,23-,24-,26+/m0/s1 |
| Molecular Structure |
|
| Density |
1.38g/cm3 |
| Boiling point |
673.7°C at 760 mmHg |
| Refractive index |
1.614 |
| Flash point |
361.2°C |
| Vapour Pressur |
4.54E-19mmHg at 25°C |
| Hazard Symbols |
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| Risk Codes |
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| Safety Description |
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