2D Structure | |
CID | 6918391 |
Target | / , / |
IUPAC Name | (1S,2S,4R)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane |
InChI | InChI=1S/C15H24/c1-7-15(6)9-8-13(11(2)3)10-14(15)12(4)5/h7,13-14H,1-2,4,8-10H2,3,5-6H3/t13-,14+,15-/m1/s1 |
InChI Key | OPFTUNCRGUEPRZ-QLFBSQMISA-N |
Canonical SMILES | CC(=C)C1CCC(C(C1)C(=C)C)(C)C=C |
Isomeric SMILES | CC(=C)[C@@H]1CC[C@@]([C@@H](C1)C(=C)C)(C)C=C |
Molecular Formula | C15H24 |
Molecular Weight | 204.35 |
synonyms | ['BETA-ELEMENE', '515-13-9', '(-)-beta-Elemene', 'beta-Elemen', 'Levo-beta-elemene', '(1S,2S,4R)-1-methyl-2,4-di(prop-1-en-2-yl)-1-vinylcyclohexane', '2,4-Diisopropenyl-1-methyl-1-vinylcyclohexane', 'beta-Elemene, (-)-', 'CHEBI:62855', 'UNII-2QG8CX6LXD', '2QG8CX6LXD', '(1S,2S,4R)-2,4-diisopropenyl-1-methyl-1-vinylcyclohexane', '(1S,2S,4R)-(-)-1-methyl-1-vinyl-2,4-diisopropenylcyclohexane', 'ELEMENE, (-)-BETA-', '(1S,2S,4R)-1-ethenyl-1-methyl-2,4-di(prop-1-en-2-yl)cyclohexane', 'Cyclohexane, 1-ethenyl-1-methyl-2,4-bis(1-methylethenyl)-, (1S-(1-alpha,2-beta,4-beta))-', '1-ethenyl-1-methyl-2,4-bis(1-methylethenyl)-cyclohexane', 'Cyclohexane, 2,4-diisopropenyl-1-methyl-1-vinyl-, (1S,2S,4R)-', 'EINECS 251-713-0', '(-)-bete-elemene', '(1S,2S,4R)-beta-elemene', 'CHEBI:62854', 'Cyclohexane, 1-ethenyl-1-methyl-2,4-bis(1-methylethenyl)-, (1alpha,2beta,4beta)-', 'rel-(1S,2S,4R)-1-ethenyl-1-methyl-2,4-di(prop-1-en-2-yl)cyclohexane', 'rel-(1S,2S,4R)-1-methyl-2,4-di(prop-1-en-2-yl)-1-vinylcyclohexane', '(1alpha,2beta,4beta)-1-ethenyl-1-methyl-2,4-bis(1-methylethenyl)cyclohexane', '251-713-0', 'Elemene', '(1S,2S,4R)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane', '(-)-b-Elemene', 'Cyclohexane, 1-ethenyl-1-methyl-2,4-bis(1-methylethenyl)-, (1S,2S,4R)-', '(+/-)-beta-Elemene', '.beta.-Elemene', '(-)-.beta.-Elemene', 'b-elemene', 'ss-Elemene', 'b-Elemen', 'Levo-b-elemene', 'E- .beta.-Elemene', '1,3,11-Elematriene', '|A-Elemene (Standard)', 'Beta elemene [WHO-DD]', 'Epitope ID:153551', 'Cyclohexane, 1-ethenyl-1-methyl-2,4-bis(1-methylethenyl)-', 'Elemene - mixture of isomers', '(-)-?-ELEMENE', 'CHEMBL448502', 'DTXSID40865690', 'DTXSID60881211', 'SDP-111', 'OPFTUNCRGUEPRZ-QLFBSQMISA-N', 'ELEMENE, (-)-.BETA.-', 'GLXC-06918', 's6957', 'AKOS028108977', '(-)-beta-Elemene, analytical standard', 'FE65904', 'HY-107324R', 'AS-82909', 'DA-61622', 'FE168536', 'HY-107324', 'CS-0028143', 'NS00096333', 'C17094', 'E79113', 'EN300-1709739', 'BRD-K21045639-001-01-2', 'Q27132237'] |
From Pubchem