(Z,3S)-1-[(2S,5Z)-2-[(Z)-hept-2-enyl]-5-methoxyiminocyclopent-3-en-1-ylidene]oct-5-en-3-ol;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(2-methoxypropyl)cyclopent-2-en-1-one;bis((4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-[(Z)-oct-2-enyl]cyclopent-2-en-1-one);2-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]-N,N-dimethylacetamide;(Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(4-pentyl-1,3-thiazol-2-yl)cyclopent-2-en-1-one;(Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;methyl (Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate;methyl (Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate

C206H301N3O30S — CID 172946707

IUPAC(Z,3S)-1-[(2S,5Z)-2-[(Z)-hept-2-enyl]-5-methoxyiminocyclopent-3-en-1-ylidene]oct-5-en-3-ol;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(2-methoxypropyl)cyclopent-2-en-1-one;bis((4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-[(Z)-oct-2-enyl]cyclopent-2-en-1-one);2-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]-N,N-dimethylacetamide;(Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(4-pentyl-1,3-thiazol-2-yl)cyclopent-2-en-1-one;(Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;methyl (Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate;methyl (Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate
SMILESCC/C=C\C/C=C\C[C@H](O)C/C=C1/C(=O)C=C[C@@H]1C/C=C\CCCC(=O)O.CC/C=C\C/C=C\C[C@H](O)C/C=C1/C(=O)C=C[C@@H]1C/C=C\CCCC(=O)OC.CC/C=C\C[C@H](O)C/C=C1/C(=O)C=C[C@@H]1C/C=C\CCCC(=O)O.CC/C=C\C[C@H](O)C/C=C1/C(=O)C=C[C@@H]1C/C=C\CCCC(=O)OC.CC/C=C\C[C@H](O)C/C=C1/C(=O)C=C[C@@H]1C/C=C\CCCCC.CC/C=C\C[C@H](O)C/C=C1/C(=O)C=C[C@@H]1C/C=C\CCCCC.CC/C=C\C[C@H](O)C/C=C1/C(=O)C=C[C@@H]1CC(=O)N(C)C.CC/C=C\C[C@H](O)C/C=C1/C(=O)C=C[C@@H]1CC(C)OC.CC/C=C\C[C@H](O)C/C=C1/C(=O)C=C[C@@H]1c1nc(CCCCC)cs1.CC/C=C\C[C@H](O)CC=C1/C(=N\OC)C=C[C@@H]1C/C=C\CCCC
InChIInChI=1S/C24H34O4.C23H32O4.C21H29NO2S.C21H33NO2.C21H30O4.2C21H32O2.C20H28O4.C17H25NO3.C17H26O3/c1-3-4-5-6-7-11-14-21(25)17-18-22-20(16-19-23(22)26)13-10-8-9-12-15-24(27)28-2;1-2-3-4-5-6-10-13-20(24)16-17-21-19(15-18-22(21)25)12-9-7-8-11-14-23(26)27;1-3-5-7-9-16-15-25-21(22-16)19-13-14-20(24)18(19)12-11-17(23)10-8-6-4-2;1-4-6-8-9-11-12-18-14-17-21(22-24-3)20(18)16-15-19(23)13-10-7-5-2;1-3-4-7-11-18(22)14-15-19-17(13-16-20(19)23)10-8-5-6-9-12-21(24)25-2;2*1-3-5-7-8-9-11-12-18-14-17-21(23)20(18)16-15-19(22)13-10-6-4-2;1-2-3-6-10-17(21)13-14-18-16(12-15-19(18)22)9-7-4-5-8-11-20(23)24;1-4-5-6-7-14(19)9-10-15-13(8-11-16(15)20)12-17(21)18(2)3;1-4-5-6-7-15(18)9-10-16-14(8-11-17(16)19)12-13(2)20-3/h4-5,7-8,10-11,16,18-21,25H,3,6,9,12-15,17H2,1-2H3;3-4,6-7,9-10,15,17-20,24H,2,5,8,11-14,16H2,1H3,(H,26,27);6,8,12-15,17,19,23H,3-5,7,9-11H2,1-2H3;7,9-11,14,16-19,23H,4-6,8,12-13,15H2,1-3H3;4-5,7-8,13,15-18,22H,3,6,9-12,14H2,1-2H3;2*6,9-11,14,16-19,22H,3-5,7-8,12-13,15H2,1-2H3;3-4,6-7,12,14-17,21H,2,5,8-11,13H2,1H3,(H,23,24);5-6,8,10-11,13-14,19H,4,7,9,12H2,1-3H3;5-6,8,10-11,13-15,18H,4,7,9,12H2,1-3H3/b5-4-,10-8-,11-7-,22-18+;4-3-,9-7-,10-6-,21-17+;8-6-,18-12+;10-7-,11-9-,20-16?,22-21-;7-4-,8-5-,19-15+;2*10-6-,11-9-,20-16+;6-3-,7-4-,18-14+;6-5-,15-10+;6-5-,16-10+/t20-,21-;19-,20-;17-,19-;18-,19-;17-,18-;2*18-,19-;16-,17-;13-,14+;13?,14-,15+/m0000000011/s1
InChIKeyBOVAVYSTXCQNNT-GMPDLOMHSA-N
MW3331.73 g/mol
LogP44.51
Rot. Bonds106

About (Z,3S)-1-[(2S,5Z)-2-[(Z)-hept-2-enyl]-5-methoxyiminocyclopent-3-en-1-ylidene]oct-5-en-3-ol;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(2-methoxypropyl)cyclopent-2-en-1-one;bis((4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-[(Z)-oct-2-enyl]cyclopent-2-en-1-one);2-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]-N,N-dimethylacetamide;(Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(4-pentyl-1,3-thiazol-2-yl)cyclopent-2-en-1-one;(Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;methyl (Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate;methyl (Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate

(Z,3S)-1-[(2S,5Z)-2-[(Z)-hept-2-enyl]-5-methoxyiminocyclopent-3-en-1-ylidene]oct-5-en-3-ol;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(2-methoxypropyl)cyclopent-2-en-1-one;bis((4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-[(Z)-oct-2-enyl]cyclopent-2-en-1-one);2-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]-N,N-dimethylacetamide;(Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(4-pentyl-1,3-thiazol-2-yl)cyclopent-2-en-1-one;(Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;methyl (Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate;methyl (Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate (PubChem CID 172946707) has the molecular formula C206H301N3O30S and a molecular weight of 3331.73 g/mol. Its IUPAC name is (Z,3S)-1-[(2S,5Z)-2-[(Z)-hept-2-enyl]-5-methoxyiminocyclopent-3-en-1-ylidene]oct-5-en-3-ol;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(2-methoxypropyl)cyclopent-2-en-1-one;bis((4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-[(Z)-oct-2-enyl]cyclopent-2-en-1-one);2-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]-N,N-dimethylacetamide;(Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(4-pentyl-1,3-thiazol-2-yl)cyclopent-2-en-1-one;(Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;methyl (Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate;methyl (Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate.

Molecular Properties

Compound Name(Z,3S)-1-[(2S,5Z)-2-[(Z)-hept-2-enyl]-5-methoxyiminocyclopent-3-en-1-ylidene]oct-5-en-3-ol;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(2-methoxypropyl)cyclopent-2-en-1-one;bis((4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-[(Z)-oct-2-enyl]cyclopent-2-en-1-one);2-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]-N,N-dimethylacetamide;(Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(4-pentyl-1,3-thiazol-2-yl)cyclopent-2-en-1-one;(Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;methyl (Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate;methyl (Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate
PubChem CID172946707
Molecular FormulaC206H301N3O30S
Molecular Weight3331.73 g/mol
Exact Mass3329.18
IUPAC Name(Z,3S)-1-[(2S,5Z)-2-[(Z)-hept-2-enyl]-5-methoxyiminocyclopent-3-en-1-ylidene]oct-5-en-3-ol;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(2-methoxypropyl)cyclopent-2-en-1-one;bis((4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-[(Z)-oct-2-enyl]cyclopent-2-en-1-one);2-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]-N,N-dimethylacetamide;(Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(4-pentyl-1,3-thiazol-2-yl)cyclopent-2-en-1-one;(Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;methyl (Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate;methyl (Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate
SMILESCC/C=C\C/C=C\C[C@H](O)C/C=C1/C(=O)C=C[C@@H]1C/C=C\CCCC(=O)O.CC/C=C\C/C=C\C[C@H](O)C/C=C1/C(=O)C=C[C@@H]1C/C=C\CCCC(=O)OC.CC/C=C\C[C@H](O)C/C=C1/C(=O)C=C[C@@H]1C/C=C\CCCC(=O)O.CC/C=C\C[C@H](O)C/C=C1/C(=O)C=C[C@@H]1C/C=C\CCCC(=O)OC.CC/C=C\C[C@H](O)C/C=C1/C(=O)C=C[C@@H]1C/C=C\CCCCC.CC/C=C\C[C@H](O)C/C=C1/C(=O)C=C[C@@H]1C/C=C\CCCCC.CC/C=C\C[C@H](O)C/C=C1/C(=O)C=C[C@@H]1CC(=O)N(C)C.CC/C=C\C[C@H](O)C/C=C1/C(=O)C=C[C@@H]1CC(C)OC.CC/C=C\C[C@H](O)C/C=C1/C(=O)C=C[C@@H]1c1nc(CCCCC)cs1.CC/C=C\C[C@H](O)CC=C1/C(=N\OC)C=C[C@@H]1C/C=C\CCCC
InChIInChI=1S/C24H34O4.C23H32O4.C21H29NO2S.C21H33NO2.C21H30O4.2C21H32O2.C20H28O4.C17H25NO3.C17H26O3/c1-3-4-5-6-7-11-14-21(25)17-18-22-20(16-19-23(22)26)13-10-8-9-12-15-24(27)28-2;1-2-3-4-5-6-10-13-20(24)16-17-21-19(15-18-22(21)25)12-9-7-8-11-14-23(26)27;1-3-5-7-9-16-15-25-21(22-16)19-13-14-20(24)18(19)12-11-17(23)10-8-6-4-2;1-4-6-8-9-11-12-18-14-17-21(22-24-3)20(18)16-15-19(23)13-10-7-5-2;1-3-4-7-11-18(22)14-15-19-17(13-16-20(19)23)10-8-5-6-9-12-21(24)25-2;2*1-3-5-7-8-9-11-12-18-14-17-21(23)20(18)16-15-19(22)13-10-6-4-2;1-2-3-6-10-17(21)13-14-18-16(12-15-19(18)22)9-7-4-5-8-11-20(23)24;1-4-5-6-7-14(19)9-10-15-13(8-11-16(15)20)12-17(21)18(2)3;1-4-5-6-7-15(18)9-10-16-14(8-11-17(16)19)12-13(2)20-3/h4-5,7-8,10-11,16,18-21,25H,3,6,9,12-15,17H2,1-2H3;3-4,6-7,9-10,15,17-20,24H,2,5,8,11-14,16H2,1H3,(H,26,27);6,8,12-15,17,19,23H,3-5,7,9-11H2,1-2H3;7,9-11,14,16-19,23H,4-6,8,12-13,15H2,1-3H3;4-5,7-8,13,15-18,22H,3,6,9-12,14H2,1-2H3;2*6,9-11,14,16-19,22H,3-5,7-8,12-13,15H2,1-2H3;3-4,6-7,12,14-17,21H,2,5,8-11,13H2,1H3,(H,23,24);5-6,8,10-11,13-14,19H,4,7,9,12H2,1-3H3;5-6,8,10-11,13-15,18H,4,7,9,12H2,1-3H3/b5-4-,10-8-,11-7-,22-18+;4-3-,9-7-,10-6-,21-17+;8-6-,18-12+;10-7-,11-9-,20-16?,22-21-;7-4-,8-5-,19-15+;2*10-6-,11-9-,20-16+;6-3-,7-4-,18-14+;6-5-,15-10+;6-5-,16-10+/t20-,21-;19-,20-;17-,19-;18-,19-;17-,18-;2*18-,19-;16-,17-;13-,14+;13?,14-,15+/m0000000011/s1
InChIKeyBOVAVYSTXCQNNT-GMPDLOMHSA-N
XLogP44.51
TPSA547.15 Ų
H-Bond Donors12
H-Bond Acceptors31
Rotatable Bonds106
Heavy Atoms240
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003331.73
LogP ≤ 544.51
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1031

Analyze (Z,3S)-1-[(2S,5Z)-2-[(Z)-hept-2-enyl]-5-methoxyiminocyclopent-3-en-1-ylidene]oct-5-en-3-ol;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(2-methoxypropyl)cyclopent-2-en-1-one;bis((4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-[(Z)-oct-2-enyl]cyclopent-2-en-1-one);2-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]-N,N-dimethylacetamide;(Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(4-pentyl-1,3-thiazol-2-yl)cyclopent-2-en-1-one;(Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;methyl (Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate;methyl (Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate with MolForge

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Launch Full Analysis

Related Compounds

(5E)-3-(2-hydroxyethyl)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]cyclopent-2-en-1-one;(5E)-3-(2-hydroxyethyl)-5-[(2E,5Z)-octa-2,5-dienylidene]cyclopent-2-en-1-one;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(2-methoxypropyl)cyclopent-2-en-1-one;bis((4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-[(Z)-oct-2-enyl]cyclopent-2-en-1-one);2-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]-N,N-dimethylacetamide;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(4-pentyl-1,3-thiazol-2-yl)cyclopent-2-en-1-one;(Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;methyl (Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate
CID 157168226
7-[5-(3-hydroxyoct-5-enylidene)-4-methoxyiminocyclopent-2-en-1-yl]hept-5-enoic acid
CID 123313420
(Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid
CID 71497989
methyl (Z)-6-[(1R,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hex-4-enoate
CID 155809003
2-(benzenesulfonyl)ethyl (Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate;(4S,5E)-5-[(3R)-4-(5-ethyl-1,3-thiazol-4-yl)-3-hydroxybutylidene]-4-[(Z)-hept-2-enyl]cyclopent-2-en-1-one;(4S,5E)-5-[(Z,3S)-3-fluorooct-5-enylidene]-4-[(Z)-hept-2-enyl]cyclopent-2-en-1-one;(4S,5E)-4-[(Z)-hept-2-enyl]-5-[(3R)-3-hydroxyoct-5-ynylidene]cyclopent-2-en-1-one;(4S,5E)-4-[(Z)-hept-2-enyl]-5-[(Z)-oct-5-enylidene]cyclopent-2-en-1-one;(4S,5E)-4-hept-2-ynyl-5-[(Z,3S)-3-hydroxyoct-5-enylidene]cyclopent-2-en-1-one;(5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(4-pentyl-1,3-thiazol-2-yl)cyclopent-2-en-1-one;methyl (Z)-7-[(1S,5E)-5-[(2E,5Z)-octa-2,5-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate;methyl (Z)-7-[(1S,5E)-5-[(Z)-oct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate;(Z)-7-[(1S,5E)-5-[(2E,5Z)-octa-2,5-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;(Z)-7-[(1S,5E)-5-[(Z)-oct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid
CID 158946303
methyl (Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxy-7-methoxyhept-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate
CID 145374127
(E)-7-[(5Z)-5-(3-hydroxyoctylidene)-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid
CID 5353560
7-[(1S,5E)-5-[(3S)-3-hydroxyoctylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid
CID 134689039
7-[5-(3-hydroxyoct-5-ynylidene)-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid
CID 123335441
methyl (Z)-7-[(1S,5E)-5-[(E)-dodec-2-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate
CID 101429474
methyl octadecanoate;(9Z,12Z,15Z)-octadeca-9,12,15-trienoic acid
CID 88695330
methane;bis((Z)-7-[(1S,5E)-5-[(E)-oct-2-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid)
CID 160562187

Frequently Asked Questions

What is the IUPAC name of (Z,3S)-1-[(2S,5Z)-2-[(Z)-hept-2-enyl]-5-methoxyiminocyclopent-3-en-1-ylidene]oct-5-en-3-ol;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(2-methoxypropyl)cyclopent-2-en-1-one;bis((4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-[(Z)-oct-2-enyl]cyclopent-2-en-1-one);2-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]-N,N-dimethylacetamide;(Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(4-pentyl-1,3-thiazol-2-yl)cyclopent-2-en-1-one;(Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;methyl (Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate;methyl (Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate?
The IUPAC name of (Z,3S)-1-[(2S,5Z)-2-[(Z)-hept-2-enyl]-5-methoxyiminocyclopent-3-en-1-ylidene]oct-5-en-3-ol;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(2-methoxypropyl)cyclopent-2-en-1-one;bis((4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-[(Z)-oct-2-enyl]cyclopent-2-en-1-one);2-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]-N,N-dimethylacetamide;(Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(4-pentyl-1,3-thiazol-2-yl)cyclopent-2-en-1-one;(Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;methyl (Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate;methyl (Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate (CID 172946707) is (Z,3S)-1-[(2S,5Z)-2-[(Z)-hept-2-enyl]-5-methoxyiminocyclopent-3-en-1-ylidene]oct-5-en-3-ol;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(2-methoxypropyl)cyclopent-2-en-1-one;bis((4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-[(Z)-oct-2-enyl]cyclopent-2-en-1-one);2-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]-N,N-dimethylacetamide;(Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(4-pentyl-1,3-thiazol-2-yl)cyclopent-2-en-1-one;(Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;methyl (Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate;methyl (Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate.
What is the SMILES notation for (Z,3S)-1-[(2S,5Z)-2-[(Z)-hept-2-enyl]-5-methoxyiminocyclopent-3-en-1-ylidene]oct-5-en-3-ol;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(2-methoxypropyl)cyclopent-2-en-1-one;bis((4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-[(Z)-oct-2-enyl]cyclopent-2-en-1-one);2-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]-N,N-dimethylacetamide;(Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(4-pentyl-1,3-thiazol-2-yl)cyclopent-2-en-1-one;(Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;methyl (Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate;methyl (Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate?
The canonical SMILES for (Z,3S)-1-[(2S,5Z)-2-[(Z)-hept-2-enyl]-5-methoxyiminocyclopent-3-en-1-ylidene]oct-5-en-3-ol;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(2-methoxypropyl)cyclopent-2-en-1-one;bis((4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-[(Z)-oct-2-enyl]cyclopent-2-en-1-one);2-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]-N,N-dimethylacetamide;(Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(4-pentyl-1,3-thiazol-2-yl)cyclopent-2-en-1-one;(Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;methyl (Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate;methyl (Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate is CC/C=C\C/C=C\C[C@H](O)C/C=C1/C(=O)C=C[C@@H]1C/C=C\CCCC(=O)O.CC/C=C\C/C=C\C[C@H](O)C/C=C1/C(=O)C=C[C@@H]1C/C=C\CCCC(=O)OC.CC/C=C\C[C@H](O)C/C=C1/C(=O)C=C[C@@H]1C/C=C\CCCC(=O)O.CC/C=C\C[C@H](O)C/C=C1/C(=O)C=C[C@@H]1C/C=C\CCCC(=O)OC.CC/C=C\C[C@H](O)C/C=C1/C(=O)C=C[C@@H]1C/C=C\CCCCC.CC/C=C\C[C@H](O)C/C=C1/C(=O)C=C[C@@H]1C/C=C\CCCCC.CC/C=C\C[C@H](O)C/C=C1/C(=O)C=C[C@@H]1CC(=O)N(C)C.CC/C=C\C[C@H](O)C/C=C1/C(=O)C=C[C@@H]1CC(C)OC.CC/C=C\C[C@H](O)C/C=C1/C(=O)C=C[C@@H]1c1nc(CCCCC)cs1.CC/C=C\C[C@H](O)CC=C1/C(=N\OC)C=C[C@@H]1C/C=C\CCCC.
What is the InChIKey of (Z,3S)-1-[(2S,5Z)-2-[(Z)-hept-2-enyl]-5-methoxyiminocyclopent-3-en-1-ylidene]oct-5-en-3-ol;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(2-methoxypropyl)cyclopent-2-en-1-one;bis((4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-[(Z)-oct-2-enyl]cyclopent-2-en-1-one);2-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]-N,N-dimethylacetamide;(Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(4-pentyl-1,3-thiazol-2-yl)cyclopent-2-en-1-one;(Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;methyl (Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate;methyl (Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate?
The InChIKey is BOVAVYSTXCQNNT-GMPDLOMHSA-N. The full InChI is InChI=1S/C24H34O4.C23H32O4.C21H29NO2S.C21H33NO2.C21H30O4.2C21H32O2.C20H28O4.C17H25NO3.C17H26O3/c1-3-4-5-6-7-11-14-21(25)17-18-22-20(16-19-23(22)26)13-10-8-9-12-15-24(27)28-2;1-2-3-4-5-6-10-13-20(24)16-17-21-19(15-18-22(21)25)12-9-7-8-11-14-23(26)27;1-3-5-7-9-16-15-25-21(22-16)19-13-14-20(24)18(19)12-11-17(23)10-8-6-4-2;1-4-6-8-9-11-12-18-14-17-21(22-24-3)20(18)16-15-19(23)13-10-7-5-2;1-3-4-7-11-18(22)14-15-19-17(13-16-20(19)23)10-8-5-6-9-12-21(24)25-2;2*1-3-5-7-8-9-11-12-18-14-17-21(23)20(18)16-15-19(22)13-10-6-4-2;1-2-3-6-10-17(21)13-14-18-16(12-15-19(18)22)9-7-4-5-8-11-20(23)24;1-4-5-6-7-14(19)9-10-15-13(8-11-16(15)20)12-17(21)18(2)3;1-4-5-6-7-15(18)9-10-16-14(8-11-17(16)19)12-13(2)20-3/h4-5,7-8,10-11,16,18-21,25H,3,6,9,12-15,17H2,1-2H3;3-4,6-7,9-10,15,17-20,24H,2,5,8,11-14,16H2,1H3,(H,26,27);6,8,12-15,17,19,23H,3-5,7,9-11H2,1-2H3;7,9-11,14,16-19,23H,4-6,8,12-13,15H2,1-3H3;4-5,7-8,13,15-18,22H,3,6,9-12,14H2,1-2H3;2*6,9-11,14,16-19,22H,3-5,7-8,12-13,15H2,1-2H3;3-4,6-7,12,14-17,21H,2,5,8-11,13H2,1H3,(H,23,24);5-6,8,10-11,13-14,19H,4,7,9,12H2,1-3H3;5-6,8,10-11,13-15,18H,4,7,9,12H2,1-3H3/b5-4-,10-8-,11-7-,22-18+;4-3-,9-7-,10-6-,21-17+;8-6-,18-12+;10-7-,11-9-,20-16?,22-21-;7-4-,8-5-,19-15+;2*10-6-,11-9-,20-16+;6-3-,7-4-,18-14+;6-5-,15-10+;6-5-,16-10+/t20-,21-;19-,20-;17-,19-;18-,19-;17-,18-;2*18-,19-;16-,17-;13-,14+;13?,14-,15+/m0000000011/s1.
What are the key properties of (Z,3S)-1-[(2S,5Z)-2-[(Z)-hept-2-enyl]-5-methoxyiminocyclopent-3-en-1-ylidene]oct-5-en-3-ol;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(2-methoxypropyl)cyclopent-2-en-1-one;bis((4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-[(Z)-oct-2-enyl]cyclopent-2-en-1-one);2-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]-N,N-dimethylacetamide;(Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(4-pentyl-1,3-thiazol-2-yl)cyclopent-2-en-1-one;(Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;methyl (Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate;methyl (Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate?
(Z,3S)-1-[(2S,5Z)-2-[(Z)-hept-2-enyl]-5-methoxyiminocyclopent-3-en-1-ylidene]oct-5-en-3-ol;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(2-methoxypropyl)cyclopent-2-en-1-one;bis((4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-[(Z)-oct-2-enyl]cyclopent-2-en-1-one);2-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]-N,N-dimethylacetamide;(Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(4-pentyl-1,3-thiazol-2-yl)cyclopent-2-en-1-one;(Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;methyl (Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate;methyl (Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate has a molecular weight of 3331.73 g/mol, XLogP of 44.51, 106 rotatable bonds, 12 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,3S)-1-[(2S,5Z)-2-[(Z)-hept-2-enyl]-5-methoxyiminocyclopent-3-en-1-ylidene]oct-5-en-3-ol;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(2-methoxypropyl)cyclopent-2-en-1-one;bis((4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-[(Z)-oct-2-enyl]cyclopent-2-en-1-one);2-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]-N,N-dimethylacetamide;(Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;(4S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-(4-pentyl-1,3-thiazol-2-yl)cyclopent-2-en-1-one;(Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid;methyl (Z)-7-[(1S,5E)-5-[(Z,3S)-3-hydroxyoct-5-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate;methyl (Z)-7-[(1S,5E)-5-[(3S,5Z,8Z)-3-hydroxyundeca-5,8-dienylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate is sourced from PubChem (CID 172946707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).