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CAS: 124-87-8 Chemical Name or Material: Cocculin (Picrotoxin) Formula Weight: 602.2 InChI Formula: InChI=1S/C15H18O7.C15H16O6/c1-12(2,18)6-7-10(16)20-8(6)9-13(3)14(7,19)4-5-15(13,22-5)11(17)21-9;1-5(2)7-8-11(16)19-9(7)10-13(3)14(8,18)4-6-15(13,21-6)12(17)20-10/h5-9,18-19H,4H2,1-3H3;6-10,18H,1,4H2,2-3H3/t5-,6+,7-,8-,9-,13-,14-,15+;6-,7+,8-,9-,10-,13-,14-,15+/m11/s1 IUPAC Name: (1aR,2aR,2a1R,3S,6R,6aS,8aS,9R)-2a-hydroxy-2a1-methyl-9-(prop-1-en-2-yl)hexahydro-8H-1,5,7-trioxa-3,6-methanocyclopenta[ij]cyclopropa[a]azulene-4,8(2a1H)-dione--(1aR,2aR,2a1R,3S,6R,6aS,8aS,9S)-2a-hydroxy-9-(2-hydroxypropan-2-yl)-2a1-methylhexahydro-8H-1,5,7-trioxa-3,6-methanocyclopenta[ij]cyclopropa[a]azulene-4,8(2a1H)-dione (1/1) Molecular Formula: C15H16O6 C15H18O7 Molecular Weight (g/mol): 602.59 Recommended Storage: -20°C SMILES: [H][C@]1(C(C)(O)C)[C@@]2([H])[C@]3(O)C[C@@H]4[C@@]5(O4)[C@]3(C)[C@]([C@]1([H])OC2=O)([H])OC5=O.[H][C@]6(C([CH2])=C)[C@@]7([H])[C@]8(O)C[C@@H]9[C@@]%10(O9)[C@]8(C)[C@]([C@]6([H])OC7=O)([H])OC%10=O Synonym: (1aR,2aR,3S,6R,6aS,8aS,8bR,9S)-Hexahydro-2a-hydroxy-9-(1-hydroxy-1-methylethyl)-8b-methyl-3,6-methano-8H-1,5,7-trioxacyclopenta[ij]cycloprop[a]azulene-4,8(3H)-dione compd. with (1aR,2aR,3S,6R,6aS,8aS,8bR,9R)-hexahydro-2a-hydroxy-8b-methyl-9-(1-methylethenyl)-3,6-methano-8H-1,5,7-trioxacyclopenta[ij]cycloprop[a]azulene-4,8(3H)-dione