Secondary metabolite: 2,3,4,5-Tetrahydro-2,7-dihydroxy-5,8,10,10-tetramethyl-2,5-methano-1-benzoxepin
Summary
Molecular formula: C15H20O3
SMILES: Oc1cc2c(cc1C)O[C@]1(C([C@]2(C)CC1)(C)C)OInChI: InChI=1S/C15H20O3/c1-9-7-12-10(8-11(9)16)14(4)5-6-15(17,18-12)13(14,2)3/h7-8,16-17H,5-6H2,1-4H3/t14-,15-/m1/s1InChIKey: KANVQRLDTGOSBL-HUUCEWRRSA-N
Molecular scaffolds
Scaffold Graph/Node/Bond level:c1ccc2c(c1)OC1CCC2C1
Scaffold Graph/Node level:C1CCC2C3CCC(C3)OC2C1
Scaffold Graph level:C1CCC2C(C1)CC1CCC2C1
Chemical classification
Kingdom: Organic compounds
Super class: Organoheterocyclic compoundsClass: Benzopyrans
Sub class: 1-benzopyrans
Synonymous chemical names:2,3,4,5-tetrahydro-2,7-dihydroxy-5,8,10,10-tetramethyl-2,5-methano-1-benzoxepin, enokipodin a
External chemical identifiers:CID_10800580; NPATLAS_NPA002497; CHEMSPIDER_10190206, CHEMSPIDER_8975886; ZINC_ZINC000015151400
Chemical structure download