Cyclic ketones

Description:

Organic compounds containing a ketone that is conjugated to a cyclic moiety.

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  1. 1-Phenyl-1-cyclohexen-3-one
    CAS: 10345-87-6 EC Number: 233-755-1 Formula: C12H12O Molecular Weight: 172.22
    Solid ≥97%
    Out of Stock Item #: C1369312
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    Technical Identifiers
    IUPAC Name
    3-phenylcyclohex-2-en-1-one
    SMILES
    C1CC(=CC(=O)C1)C2=CC=CC=C2
    InChIKey
    DIELDZAPFMXAHA-UHFFFAOYSA-N
    InChI
    1S/C12H12O/c13-12-8-4-7-11(9-12)10-5-2-1-3-6-10/h1-3,5-6,9H,4,7-8H2
    Synonyms
    1-Phenylcyclohexen-3-one | 3-Phenyl-2-cyclohexen-1-one | 3-Phenyl-2-cyclohexene-1-one | 3-Phenyl-2-cyclohexenone | NS...
  2. Rubropunctatin
    CAS: 514-67-0 PubChem CID: 6452445
    Out of Stock Item #: R1002565
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    IUPAC Name
    (9aR)-3-hexanoyl-9a-methyl-6-[(E)-prop-1-enyl]furo[3,2-g]isochromene-2,9-dione
    SMILES
    CCCCCC(=O)C1=C2C=C3C=C(OC=C3C(=O)C2(OC1=O)C)C=CC
    InChIKey
    SULYDLFVUNXAMP-WKOQKXSESA-N
    InChI
    1S/C21H22O5/c1-4-6-7-9-17(22)18-16-11-13-10-14(8-5-2)25-12-15(13)19(23)21(16,3)26-20(18)24/h5,8,10-12H,4,6-7,9H2,1-3H3/b8-5+/t21-/m1/s1
  3. LP-184
    CAS: 924835-67-6 Formula: C16H20N2O4 Molecular Weight: 304.340
    Out of Stock Item #: L942166
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    IUPAC Name
    1-hydroxy-1-[[(5'R)-5'-hydroxy-2',5',7'-trimethyl-4'-oxospiro[cyclopropane-1,6'-indene]-1'-yl]methyl]urea
    SMILES
    CC1=C(C2=C(C3(CC3)[C@@](C(=O)C2=C1)(C)O)C)CN(C(=O)N)O
    InChIKey
    VWMPVAZEBAKLFR-HNNXBMFYSA-N
    InChI
    1S/C16H20N2O4/c1-8-6-10-12(11(8)7-18(22)14(17)20)9(2)16(4-5-16)15(3,21)13(10)19/h6,21-22H,4-5,7H2,1-3H3,(H2,17,20)/t15-/m0/s1
  4. Desoxo-Narchinol A
    CAS: 53859-06-6 PubChem CID: 56835056
    Out of Stock Item #: D931701
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    IUPAC Name
    (4R,4aS,5R)-4-hydroxy-4a,5-dimethyl-4,5,6,7-tetrahydronaphthalen-1-one
    SMILES
    CC1CCC=C2C1(C(C=CC2=O)O)C
    InChIKey
    YWSIMWUTQXMOSD-FXAINCCUSA-N
    InChI
    1S/C12H16O2/c1-8-4-3-5-9-10(13)6-7-11(14)12(8,9)2/h5-8,11,14H,3-4H2,1-2H3/t8-,11-,12+/m1/s1
  5. Diaziquone
    CAS: 57998-68-2 Formula: C16H20N4O6 Molecular Weight: 364.35
    Out of Stock Item #: D1362300
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    IUPAC Name
    ethyl N-[2,5-bis(aziridin-1-yl)-4-(ethoxycarbonylamino)-3,6-dioxocyclohexa-1,4-dien-1-yl]carbamate
    SMILES
    CCOC(=O)NC1=C(C(=O)C(=C(C1=O)N2CC2)NC(=O)OCC)N3CC3
    InChIKey
    WVYXNIXAMZOZFK-UHFFFAOYSA-N
    InChI
    1S/C16H20N4O6/c1-3-25-15(23)17-9-11(19-5-6-19)14(22)10(18-16(24)26-4-2)12(13(9)21)20-7-8-20/h3-8H2,1-2H3,(H,17,23)(H,18,24)
  6. 2,5-Bis(1-aziridinyl)-3-(hydroxymethyl)-6-methyl-2,5-cyclohexadiene-1,4-dione
    CAS: 221635-42-3 Formula: C12H14N2O3 Molecular Weight: 234.25
    Out of Stock Item #: B1355245
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    Technical Identifiers
    IUPAC Name
    2,5-bis(aziridin-1-yl)-3-(hydroxymethyl)-6-methylcyclohexa-2,5-diene-1,4-dione
    SMILES
    CC1=C(C(=O)C(=C(C1=O)N2CC2)CO)N3CC3
    InChIKey
    JKDLOGLNPDVUCX-UHFFFAOYSA-N
    InChI
    1S/C12H14N2O3/c1-7-9(13-2-3-13)12(17)8(6-15)10(11(7)16)14-4-5-14/h15H,2-6H2,1H3
  7. 2,5-Diaminocyclohexa-2,5-diene-1,4-dione
    CAS: 1521-06-8 PubChem CID: 164848 Formula: C6H6N2O2 Molecular Weight: 138.12
    Out of Stock Item #: D768756
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    Technical Identifiers
    IUPAC Name
    2,5-diaminocyclohexa-2,5-diene-1,4-dione
    SMILES
    C1=C(C(=O)C=C(C1=O)N)N
    InChIKey
    VUVVIURXJWHENR-UHFFFAOYSA-N
    InChI
    1S/C6H6N2O2/c7-3-1-5(9)4(8)2-6(3)10/h1-2H,7-8H2
  8. 3-ethylcyclopent-2-en-1-one
    CAS: 5682-69-9 Formula: C7H10O Molecular Weight: 110.1537
    Out of Stock Item #: E769262
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    Technical Identifiers
    SMILES
    CCC1=CC(=O)CC1
    InChIKey
    XHAHAEVXYYITIQ-UHFFFAOYSA-N
    InChI
    1S/C7H10O/c1-2-6-3-4-7(8)5-6/h5H,2-4H2,1H3
  9. 3-Dehydroshikimic acid
    CAS: 2922-42-1 EC Number: 634-499-7 PubChem CID: 439774 Formula: C7H8O5 Molecular Weight: 172.14
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    Out of Stock Item #: D769204
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    Technical Identifiers
    IUPAC Name
    (4S,5R)-4,5-dihydroxy-3-oxocyclohexene-1-carboxylic acid
    SMILES
    C1C(C(C(=O)C=C1C(=O)O)O)O
    InChIKey
    SLWWJZMPHJJOPH-PHDIDXHHSA-N
    InChI
    1S/C7H8O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1,5-6,9-10H,2H2,(H,11,12)/t5-,6-/m1/s1
  10. 2-hydroxy-3,4-dimethylcyclopent-2-en-1-one
    CAS: 21835-00-7 Formula: C7H10O2 Molecular Weight: 126.1531
    Out of Stock Item #: H769132
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    Technical Identifiers
    SMILES
    CC1CC(=O)C(=C1C)O
    InChIKey
    GXUQPCUHTNAVRJ-UHFFFAOYSA-N
    InChI
    1S/C7H10O2/c1-4-3-6(8)7(9)5(4)2/h4,9H,3H2,1-2H3
  11. 1,4-Cyclohexanedione-d8
    CAS: 23034-25-5 Formula: C6D8O2 Molecular Weight: 120.18
    In Stock Item #: C757276
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    Technical Identifiers
    IUPAC Name
    2,2,3,3,5,5,6,6-octadeuteriocyclohexane-1,4-dione
    SMILES
    C1CC(=O)CCC1=O
    InChIKey
    DCZFGQYXRKMVFG-SVYQBANQSA-N
    InChI
    1S/C6H8O2/c7-5-1-2-6(8)4-3-5/h1-4H2/i1D2,2D2,3D2,4D2
    Synonyms
    1,4-Cyclohexanedione-2,2,3,3,5,5,6,6-d8 | cyclohexane-1,4-dione-d8
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