Transcription

Cas#: 68-26-8        Compound CID:  445354

Formula:  C₂₀H₃₀O        Molecular Weight: 286.45

IUPAC Name: (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraen-1-ol

SMILES: CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CCO)C)C

InChIKey: FPIPGXGPPPQFEQ-OVSJKPMPSA-N

InChI: InChI=1S/C20H30O/c1-16(8-6-9-17(2)13-15-21)11-12-19-18(3)10-7-14-20(19,4)5/h6,8-9,11-13,21H,7,10,14-15H2,1-5H3/b9-6+,12-11+,16-8+,17-13+

Cas#: 87893-55-8        Compound CID:  5311211

Formula:  C₂₀H₂₈O₃        Molecular Weight: 316.5

IUPAC Name: (Z)-7-[(1S,5E)-5-[(E)-oct-2-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid

SMILES: CCCCCC=CC=C1C(C=CC1=O)CC=CCCCC(=O)O

InChIKey: VHRUMKCAEVRUBK-GODQJPCRSA-N

InChI: InChI=1S/C20H28O3/c1-2-3-4-5-6-10-13-18-17(15-16-19(18)21)12-9-7-8-11-14-20(22)23/h6-7,9-10,13,15-17H,2-5,8,11-12,14H2,1H3,(H,22,23)/b9-7-,10-6+,18-13+/t17-/m0/s1

Cas#: 52665-74-4        Compound CID:  6438330

Formula:  C₃₁H₃₈N₂O₇        Molecular Weight: 550.64

IUPAC Name: (2E,4E,6R)-N-[(1S,5S,6R)-5-hydroxy-5-[(1E,3E,5E)-7-[(2-hydroxy-5-oxocyclopenten-1-yl)amino]-7-oxohepta-1,3,5-trienyl]-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]-2,4,6-trimethyldeca-2,4-dienamide

SMILES: CCCCC(C)C=C(C)C=C(C)C(=O)NC1=CC(C2C(C1=O)O2)(C=CC=CC=CC(=O)NC3=C(CCC3=O)O)O

InChIKey: TWWQHCKLTXDWBD-MVTGTTCWSA-N

InChI: InChI=1S/C31H38N2O7/c1-5-6-11-19(2)16-20(3)17-21(4)30(38)32-22-18-31(39,29-28(40-29)27(22)37)15-10-8-7-9-12-25(36)33-26-23(34)13-14-24(26)35/h7-10,12,15-19,28-29,34,39H,5-6,11,13-14H2,1-4H3,(H,32,38)(H,33,36)/b8-7+,12-9+,15-10+,20-16+,21-17+/t19-,28-,29-,31+/m1/s1

Formula:  C₄₁H₄₂N₂O₇S        Molecular Weight: 706.85

Cas#: 130-26-7        Compound CID:  2788

Formula:  C₉H₅ClINO        Molecular Weight: 305.5

IUPAC Name: 5-chloro-7-iodoquinolin-8-ol

SMILES: C1=CC2=C(C(=C(C=C2Cl)I)O)N=C1

InChIKey: QCDFBFJGMNKBDO-UHFFFAOYSA-N

InChI: InChI=1S/C9H5ClINO/c10-6-4-7(11)9(13)8-5(6)2-1-3-12-8/h1-4,13H

Cas#: 154675-18-0        Compound CID:  3568

Formula:  C₁₆H₁₈O₈        Molecular Weight: 338.3

IUPAC Name: 5-(methoxymethyl)-4-[2,3,4-trihydroxy-6-(methoxymethyl)phenyl]benzene-1,2,3-triol

SMILES: COCC1=CC(=C(C(=C1C2=C(C(=C(C=C2COC)O)O)O)O)O)O

InChIKey: NEBCAMAQXZIVRE-UHFFFAOYSA-N

InChI: InChI=1S/C16H18O8/c1-23-5-7-3-9(17)13(19)15(21)11(7)12-8(6-24-2)4-10(18)14(20)16(12)22/h3-4,17-22H,5-6H2,1-2H3

Cas#: 41575-94-4        Compound CID:  426756

Formula:  C₆H₁₂N₂O₄Pt        Molecular Weight: 371.25

IUPAC Name: azanide;cyclobutane-1,1-dicarboxylic acid;platinum(2+)

SMILES: C1CC(C1)(C(=O)O)C(=O)O.[NH2-].[NH2-].[Pt+2]

InChIKey: VSRXQHXAPYXROS-UHFFFAOYSA-N

InChI: InChI=1S/C6H8O4.2H2N.Pt/c7-4(8)6(5(9)10)2-1-3-6;;;/h1-3H2,(H,7,8)(H,9,10);2*1H2;/q;2*-1;+2

Cas#: 97322-87-7        Compound CID:  5591

Formula:  C₂₄H₂₇NO₅S        Molecular Weight: 441.54

IUPAC Name: 5-[[4-[(6-hydroxy-2,5,7,8-tetramethyl-3,4-dihydrochromen-2-yl)methoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione

SMILES: CC1=C(C2=C(CCC(O2)(C)COC3=CC=C(C=C3)CC4C(=O)NC(=O)S4)C(=C1O)C)C

InChIKey: GXPHKUHSUJUWKP-UHFFFAOYSA-N

InChI: InChI=1S/C24H27NO5S/c1-13-14(2)21-18(15(3)20(13)26)9-10-24(4,30-21)12-29-17-7-5-16(6-8-17)11-19-22(27)25-23(28)31-19/h5-8,19,26H,9-12H2,1-4H3,(H,25,27,28)

Cas#: 148-24-3        Compound CID:  1923

Formula:  C₉H₇NO        Molecular Weight: 145.16

IUPAC Name: quinolin-8-ol

SMILES: C1=CC2=C(C(=C1)O)N=CC=C2

InChIKey: MCJGNVYPOGVAJF-UHFFFAOYSA-N

InChI: InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H

Cas#: 923564-51-6        Compound CID:  24978538

Formula:  C₄₇H₅₅ClF₃N₅O₆S₃        Molecular Weight: 974.61

IUPAC Name: 4-[4-[[2-(4-chlorophenyl)-5,5-dimethylcyclohexen-1-yl]methyl]piperazin-1-yl]-N-[4-[[(2R)-4-morpholin-4-yl-1-phenylsulfanylbutan-2-yl]amino]-3-(trifluoromethylsulfonyl)phenyl]sulfonylbenzamide

SMILES: CC1(CCC(=C(C1)CN2CCN(CC2)C3=CC=C(C=C3)C(=O)NS(=O)(=O)C4=CC(=C(C=C4)NC(CCN5CCOCC5)CSC6=CC=CC=C6)S(=O)(=O)C(F)(F)F)C7=CC=C(C=C7)Cl)C

InChIKey: JLYAXFNOILIKPP-KXQOOQHDSA-N

InChI: InChI=1S/C47H55ClF3N5O6S3/c1-46(2)20-18-42(34-8-12-37(48)13-9-34)36(31-46)32-55-22-24-56(25-23-55)39-14-10-35(11-15-39)45(57)53-65(60,61)41-16-17-43(44(30-41)64(58,59)47(49,50)51)52-38(19-21-54-26-28-62-29-27-54)33-63-40-6-4-3-5-7-40/h3-17,30,38,52H,18-29,31-33H2,1-2H3,(H,53,57)/t38-/m1/s1

Cas#: 133550-30-8        Compound CID:  5328779

Formula:  C₁₇H₁₄N₂O₃        Molecular Weight: 294.3

IUPAC Name: (E)-N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide

SMILES: C1=CC=C(C=C1)CNC(=O)C(=CC2=CC(=C(C=C2)O)O)C#N

InChIKey: TUCIOBMMDDOEMM-RIYZIHGNSA-N

InChI: InChI=1S/C17H14N2O3/c18-10-14(8-13-6-7-15(20)16(21)9-13)17(22)19-11-12-4-2-1-3-5-12/h1-9,20-21H,11H2,(H,19,22)/b14-8+