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Prostaglandin E2 (PGE2)CAS号 : 363-24-6(DMSO)分子式: C20H32O5 分子量: 352.47SMILES: CCCCCC(O)/C=C/C1C(O)CC(=O)C1C\C=C/CCCC(O)=O
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AlprostadilCAS号 : 745-65-3(DMSO)分子式: C20H34O5 分子量: 354.48SMILES: CCCCCC(O)/C=C/C1C(O)CC(=O)C1CCCCCCC(O)=O
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D-赤型鞘氨醇分子式: C18H37NO2 分子量: 299.492IUPAC Name: (E,2S,3R)-2-aminooctadec-4-ene-1,3-diolSMILES: CCCCCCCCCCCCCC=CC(C(CO)N)OInChIKey: WWUZIQQURGPMPG-KRWOKUGFSA-NInChI: InChI=1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h14-15,17-18,20-21H,2-13,16,19H2,1H3/b15-14+/t17-,18+/m0/s1
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2-(2,6-二氯苯氨基)苯乙酸CAS号 : 15307-86-5分子式: C14H11Cl2NO2 分子量: 296.15IUPAC Name: 2-[2-(2,6-dichloroanilino)phenyl]acetic acidSMILES: C1=CC=C(C(=C1)CC(=O)O)NC2=C(C=CC=C2Cl)ClInChIKey: DCOPUUMXTXDBNB-UHFFFAOYSA-NInChI: InChI=1S/C14H11Cl2NO2/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19/h1-7,17H,8H2,(H,18,19)
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异樱红素分子式: C16H14O5 分子量: 286.28IUPAC Name: (2S)-5,7-dihydroxy-2-(4-methoxyphenyl)-2,3-dihydrochromen-4-oneSMILES: COC1=CC=C(C=C1)C2CC(=O)C3=C(C=C(C=C3O2)O)OInChIKey: HMUJXQRRKBLVOO-AWEZNQCLSA-NInChI: InChI=1S/C16H14O5/c1-20-11-4-2-9(3-5-11)14-8-13(19)16-12(18)6-10(17)7-15(16)21-14/h2-7,14,17-18H,8H2,1H3/t14-/m0/s1
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米索前列醇CAS号 : 59122-46-2 Compound CID : 5282381分子式: C22H38O5 分子量: 382.53IUPAC Name: methyl 7-[(1R,2R,3R)-3-hydroxy-2-[(E)-4-hydroxy-4-methyloct-1-enyl]-5-oxocyclopentyl]heptanoateSMILES: CCCCC(C)(CC=CC1C(CC(=O)C1CCCCCCC(=O)OC)O)OInChIKey: OJLOPKGSLYJEMD-URPKTTJQSA-NInChI: InChI=1S/C22H38O5/c1-4-5-14-22(2,26)15-10-12-18-17(19(23)16-20(18)24)11-8-6-7-9-13-21(25)27-3/h10,12,17-18,20,24,26H,4-9,11,13-16H2,1-3H3/b12-10+/t17-,18-,20-,22?/m1/s1
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硝苯地平CAS号 : 21829-25-4 Compound CID : 4485分子式: C17H18N2O6 分子量: 346.33IUPAC Name: dimethyl 2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylateSMILES: CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC=CC=C2[N+](=O)[O-])C(=O)OCInChIKey: HYIMSNHJOBLJNT-UHFFFAOYSA-NInChI: InChI=1S/C17H18N2O6/c1-9-13(16(20)24-3)15(14(10(2)18-9)17(21)25-4)11-7-5-6-8-12(11)19(22)23/h5-8,15,18H,1-4H3
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ONO-AE3-208,性EP4拮抗剂CAS号 : 402473-54-5 Compound CID : 10111831分子式: C24H21FN2O3 分子量: 404.43IUPAC Name: 4-[4-cyano-2-[2-(4-fluoronaphthalen-1-yl)propanoylamino]phenyl]butanoic acidSMILES: CC(C1=CC=C(C2=CC=CC=C21)F)C(=O)NC3=C(C=CC(=C3)C#N)CCCC(=O)OInChIKey: MTDIMKNAJUQTIO-UHFFFAOYSA-NInChI: InChI=1S/C24H21FN2O3/c1-15(18-11-12-21(25)20-7-3-2-6-19(18)20)24(30)27-22-13-16(14-26)9-10-17(22)5-4-8-23(28)29/h2-3,6-7,9-13,15H,4-5,8H2,1H3,(H,27,30)(H,28,29)
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扑米酮分子式: C12H14N2O2 分子量: 218.25IUPAC Name: 5-ethyl-5-phenyl-1,3-diazinane-4,6-dioneSMILES: CCC1(C(=O)NCNC1=O)C2=CC=CC=C2InChIKey: DQMZLTXERSFNPB-UHFFFAOYSA-NInChI: InChI=1S/C12H14N2O2/c1-2-12(9-6-4-3-5-7-9)10(15)13-8-14-11(12)16/h3-7H,2,8H2,1H3,(H,13,15)(H,14,16)
