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鸦胆子素DCAS号: 21499-66-1分子式: C20H26O9 分子量: 410.42IUPAC Name: (1R,2R,3R,6R,8S,12S,13S,14R,15R,16S,17R)-2,3,12,15,16-pentahydroxy-9,13,17-trimethyl-5,18-dioxapentacyclo[12.5.0.01,6.02,17.08,13]nonadec-9-ene-4,11-dioneSMILES: CC1=CC(=O)C(C2(C1CC3C45C2C(C(C(C4(C(C(=O)O3)O)O)(OC5)C)O)O)C)OInChIKey: JBDMZGKDLMGOFR-KQSRGDCESA-NInChI: 1S/C20H26O9/c1-7-4-9(21)13(23)17(2)8(7)5-10-19-6-28-18(3,14(24)11(22)12(17)19)20(19,27)15(25)16(26)29-10/h4,8,10-15,22-25,27H,5-6H2,1-3H3/t8-,10+,11+,12+,13+,14-,15-,17-,18+,19+,20+/m0/s1
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醋酸泼尼松分子式: C23H28O6 分子量: 400.46IUPAC Name: [2-[(8S,9S,10R,13S,14S,17R)-17-hydroxy-10,13-dimethyl-3,11-dioxo-6,7,8,9,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetateSMILES: CC(=O)OCC(=O)C1(CCC2C1(CC(=O)C3C2CCC4=CC(=O)C=CC34C)C)OInChIKey: MOVRKLZUVNCBIP-RFZYENFJSA-NInChI: 1S/C23H28O6/c1-13(24)29-12-19(27)23(28)9-7-17-16-5-4-14-10-15(25)6-8-21(14,2)20(16)18(26)11-22(17,23)3/h6,8,10,16-17,20,28H,4-5,7,9,11-12H2,1-3H3/t16-,17-,20+,21-,22-,23-/m0/s1
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FLI-06CAS号: 313967-18-9分子式: C25H30N2O5 分子量: 438.52IUPAC Name: cyclohexyl 2,7,7-trimethyl-4-(4-nitrophenyl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylateSMILES: CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OC4CCCCC4InChIKey: SWWVFYHSSOWZMF-UHFFFAOYSA-NInChI: 1S/C25H30N2O5/c1-15-21(24(29)32-18-7-5-4-6-8-18)22(16-9-11-17(12-10-16)27(30)31)23-19(26-15)13-25(2,3)14-20(23)28/h9-12,18,22,26H,4-8,13-14H2,1-3H3
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卢米黄素分子式: C13H12N4O2 分子量: 256.26IUPAC Name: 7,8,10-trimethylbenzo[g]pteridine-2,4-dioneSMILES: CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)CInChIKey: KPDQZGKJTJRBGU-UHFFFAOYSA-NInChI: 1S/C13H12N4O2/c1-6-4-8-9(5-7(6)2)17(3)11-10(14-8)12(18)16-13(19)15-11/h4-5H,1-3H3,(H,16,18,19)
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原花青素B2 3,3'-二-O-没食子酸酯CAS号: 79907-44-1 Compound CID : 124016分子式: C44H34O20 分子量: 882.73IUPAC Name: See more
SMILES: C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)OC(=O)C6=CC(=C(C(=C6)O)O)O)O)O)C7=CC(=C(C=C7)O)O)OC(=O)C8=CC(=C(C(=C8)O)O)OInChIKey: KTLUHRSHFRODPS-RIQPQZJCSA-NInChI: See more -
睡茄素ACAS号: 32911-62-9 Compound CID : 11294368分子式: C28H38O6 分子量: 470.6IUPAC Name: (1S,2S,4S,5R,10R,11S,14S,15S,18S)-15-[(1R)-1-[(2R)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]-1-hydroxyethyl]-5-hydroxy-10,14-dimethyl-3-oxapentacyclo[9.7.0.02,4.05,10.014,18]octadec-7-en-9-oneSMILES: CC1=C(C(=O)OC(C1)C(C)(C2CCC3C2(CCC4C3C5C(O5)C6(C4(C(=O)C=CC6)C)O)C)O)CInChIKey: DXWHOKCXBGLTMQ-SFQAJKIESA-NInChI: See more
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IMR-1ACAS号: 331862-41-0分子式: C13H11NO5S2 分子量: 325.36IUPAC Name: 2-[2-methoxy-4-[(E)-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]acetic acidSMILES: COC1=C(C=CC(=C1)C=C2C(=O)NC(=S)S2)OCC(=O)OInChIKey: DVBJNSKWHSGTDK-BJMVGYQFSA-NInChI: 1S/C13H11NO5S2/c1-18-9-4-7(2-3-8(9)19-6-11(15)16)5-10-12(17)14-13(20)21-10/h2-5H,6H2,1H3,(H,15,16)(H,14,17,20)/b10-5+
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双酚钠CAS号: 76584-70-8分子式: C16H32NaO4 分子量: 311.42IUPAC Name: sodium;2-propylpentanoate;2-propylpentanoic acidSMILES: CCCC(CCC)C(=O)O.CCCC(CCC)C(=O)[O-].[Na+]InChIKey: MSRILKIQRXUYCT-UHFFFAOYSA-MInChI: 1S/2C8H16O2.Na/c2*1-3-5-7(6-4-2)8(9)10;/h2*7H,3-6H2,1-2H3,(H,9,10);/q;;+1/p-1
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Crenigacestat (LY3039478)CAS号: 1421438-81-4分子式: C22H23F3N4O4 分子量: 464.44IUPAC Name: 4,4,4-trifluoro-N-[(2S)-1-[[(7S)-5-(2-hydroxyethyl)-6-oxo-7H-pyrido[2,3-d][3]benzazepin-7-yl]amino]-1-oxopropan-2-yl]butanamideSMILES: CC(C(=O)NC1C2=CC=CC=C2C3=C(N=CC=C3)N(C1=O)CCO)NC(=O)CCC(F)(F)FInChIKey: YCBAQKQAINQRFW-UGSOOPFHSA-NInChI: 1S/C22H23F3N4O4/c1-13(27-17(31)8-9-22(23,24)25)20(32)28-18-15-6-3-2-5-14(15)16-7-4-10-26-19(16)29(11-12-30)21(18)33/h2-7,10,13,18,30H,8-9,11-12H2,1H3,(H,27,31)(H,28,32)/t13-,18-/m0/s1
