| 2D Structure | |
| CID | 442292 |
| IUPAC Name | (1R,3R,5S,8S,9R,12S,13R,14R)-1-hydroxy-13-methyl-14-prop-1-en-2-yl-4,7,10-trioxapentacyclo[6.4.1.19,12.03,5.05,13]tetradecane-6,11-dione |
| InChI | InChI=1S/C15H16O6/c1-5(2)7-8-11(16)19-9(7)10-13(3)14(8,18)4-6-15(13,21-6)12(17)20-10/h6-10,18H,1,4H2,2-3H3/t6-,7+,8-,9-,10-,13-,14-,15+/m1/s1 |
| InChI Key | PIMZUZSSNYHVCU-YKWPQBAZSA-N |
| Canonical SMILES | None |
| Isomeric SMILES | None |
| Molecular Formula | C15H16O6 |
| Molecular Weight | 292.28 |
| synonyms | ['picrotoxinin', '17617-45-7', 'Picrotoxinine', '(-)-Picrotoxinin', '9K011NUF0R', 'CHEBI:8206', 'DTXSID3074311', 'NSC-129537', '(1R,3R,5S,8S,9R,12S,13R,14R)-1-hydroxy-13-methyl-14-prop-1-en-2-yl-4,7,10-trioxapentacyclo[6.4.1.19,12.03,5.05,13]tetradecane-6,11-dione', '(1R,3R,5S,8S,9R,12S,13R,14R)-1-hydroxy-13-methyl-14-prop-1-en-2-yl-4,7,10-trioxapentacyclo(6.4.1.19,12.03,5.05,13)tetradecane-6,11-dione', 'DTXCID6035603', '(1aR-(1a alpha,2a beta,3 beta,6 beta,6a beta,8aS*,8b beta,9R*))-hexahydro-2a-hydroxy-8b-methyl-9-(1-methylethenyl)-3,6-methano-8H-1,5,7-trioxa cyclopenta(ij)cycloprop(a)azulene-4,8(3H)-dione', '(1S,3S,5R,9S,12R,13S,14S)-1-hydroxy-13-methyl-14-prop-1-en-2-yl-4,7,10-trioxapentacyclo(6.4.1.19,12.03,5.05,13)tetradecane-6,11-dione', '634-009-1', 'CHEMBL47244', '3,6-Methano-8H-1,5,7-trioxacyclopenta[ij]cycloprop[a]azulene-4,8(3H)-dione, hexahydro-2a-hydroxy-8b-methyl-9-(1-methylethenyl)-, (1aR,2aR,3S,6R,6aS,8aS,8bR,9R)-', '(1aR-(1aalpha,2abeta,3beta,6beta,6abeta,8aS*,8bbeta,9R*))-Hexahydro-2a-hydroxy-8b-methyl-9-(1-methylethenyl)-3,6-methano-8H-1,5,7-trioxa cyclopenta(ij)cycloprop(a)azulene-4,8(3H)-dione', '(5S,8S,12S,1R,3R,9R,13R,14R)-1-hydroxy-13-methyl-14-(1-methylvinyl)-4,7,10-tri oxapentacyclo[6.4.1.1<9,12>.0<3,5>.0<5,13>]tetradecane-6,11-dione', '3,6-Methano-8H-1,5,7-trioxacyclopenta(ij)cycloprop(a)azulene-4,8(3H)-dione, hexahydro-2a-hydroxy-8b-methyl-9-(1-methylethenyl)-, (1aR,2aR,3S,6R,6aS,8aS,8bR,9R)-', 'UNII-9K011NUF0R', 'Picrotoxinin?', '(1aR,2aR,3S,6R,6aS,8aS,8bR,9R)-2a-hydroxy-8b-methyl-9-(prop-1-en-2-yl)hexahydro-3,6-methano-1,5,7-trioxacyclopenta[ij]c yclopropa[a]azulene-4,8(3H)-dione', 'RI5', 'NSC 129537', 'Picrotoxin (Part b)', 'Spectrum_001292', 'Picrotoxinin (Standard)', 'AI3-41571', 'Spectrum2_001085', 'Spectrum3_001437', 'Spectrum4_000911', 'Spectrum5_001313', 'PICROTOXININ [MI]', 'Biomol-NT_000265', 'BSPBio_003174', 'KBioGR_001402', 'KBioSS_001772', 'DivK1c_000595', 'SCHEMBL559915', 'SPBio_001130', 'BPBio1_001035', 'GTPL2291', 'orb1706790', 'HMS501N17', 'HY-B1494R', 'KBio1_000595', 'KBio2_001772', 'KBio2_004340', 'KBio2_006908', 'KBio3_002394', 'NINDS_000595', 'PIMZUZSSNYHVCU-YKWPQBAZSA-N', 'HY-B1494', 'BDBM50017684', 'CCG-39761', 'MSK173034', 'yclopropa[a]azulene-4,8(3H)-dione', 'AKOS024282617', 'FP66477', 'LMPR0103540001', 'SDCCGMLS-0066690.P001', 'IDI1_000595', '3-(1-Methyl-pyrrolidin-2-yl)-pyridine', 'NCGC00142524-03', 'DA-66719', 'MS-24176', 'ST057243', 'Picrotoxinin (from Anamirta cocculus seed)', 'CS-0013192', 'NS00096924', 'C09529', 'G12278', 'BRD-K95554982-001-03-3', 'Q27088387', '(1aR,2aR,3S,6R,6aS,8aS,8bR,9R)-2a-hydroxy-8b-methyl-9-(prop-1-en-2-yl)hexahydro-3,6-methano-1,5,7-trioxacyclopenta[ij]c', '(1ar,2ar,3s,6r,6as,8as,8br,9r)-2a-Hydroxy-8b-Methyl-9-(Prop-1-En-2-Yl)hexahydro-3,6-Methano-1,5,7-Trioxacyclopenta[ij]cyclopropa[a]azulene-4,8(3h)-Dione', '(1R,3R,5S,8S,9R,12S,13R,14R)-1-hydroxy-13-methyl-14-(prop-1-en-2-yl)-4,7,10-trioxapentacyclo[6.4.1.1(9,12).0(3,5).0(5,13)]tetradecane-6,11-dione', '(1R,3R,5S,8S,9R,12S,13R,14R)-1-hydroxy-14-isopropenyl-13-methyl-4,7,10-trioxapentacyclo[6.4.1.19,12.03,5.05,13]tetradecane-6,11-dione', '1-hydroxy-14-isopropenyl-13-methyl-(1R,3R,5S,8S,9R,12S,13R,14R)-4,7,10-trioxapentacyclo[6.4.1.19,12.03,5.05,13]tetradecane-6,11-dione', '1-hydroxy-14-isopropenyl-13-methyl-(1R,3R,5S,8S,9R,12S,13R,14R)-4,7,10-trioxapentacyclo[6.4.1.19,12.03,5.05,13]tetradecane-6,11-dione(picrotoxin)', '3,6-Methano-8H-1,5,7-trioxacyclopenta(ij)cycloprop(a)azulene-4,8(3H)-dione, hexahydro-2a-hydroxy-8b-methyl-9-(1-methylethenyl)-, (1aR-(1a-alpha,2a-beta,3-beta,6-beta,6a-beta,8as*,8b-beta,9R*))-', 'PICROTOXININ1-hydroxy-14-isopropenyl-13-methyl-(1R,3R,5S,8S,9R,12S,13R,14R)-4,7,10-trioxapentacyclo[6.4.1.19,12.03,5.05,13]tetradecane-6,11-dione(picrotoxinin)'] |
From Pubchem