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Search results for: '2130869-18-8'
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(12E,20Z,18S)-8-hydroxyvariabilin, Antagonist of glycine receptor α3 subunit
SMILES: C/C(=C\CCC(CCCc1cocc1)(O)C)/CCC[C@@H](/C=C/1\OC(=O)C(=C1O)C)CInChIKey: QFBUNOKEKXMSCV-UYYPKTQPSA-NInChI: InChI=1S/C25H36O5/c1-18(8-5-9-19(2)16-22-23(26)20(3)24(27)30-22)10-6-13-25(4,28)14-7-11-21-12-15-29-17-21/h10,12,15-17,19,26,28H,5-9,11,13-14H2,1-4H3/b18-10+,22-16-/t19-,25?/m0/s1
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7-chloro-3-oxo-8-(1,3-thiazol-5-ylmethylamino)-11,16-dioxa-2,4,19,21-tetrazatricyclo[15.3.1.05,10]henicosa-1(20),5,7,9,17(21),18-hexaene-18-carbonitrile, Inhibitor of checkpoint kinase 1;Inhibitor of fms related receptor tyrosine kinase 1;Inhibitor of muscle associated receptor tyrosine kinase;Inhibitor of nemo like kinase;Inhibitor of NIMA related kinase 11;Inhibitor of NIMA related kinase 3;Inhibitor of
Synonyms: compound 25SMILES: N#Cc1ncc2nc1OCCCCOc1c(NC(=O)N2)cc(Cl)c(c1)NCc1cncs1InChIKey: AZTMYWWWILJAKW-UHFFFAOYSA-NInChI: InChI=1S/C20H18ClN7O3S/c21-13-5-15-17(6-14(13)24-9-12-8-23-11-32-12)30-3-1-2-4-31-19-16(7-22)25-10-18(27-19)28-20(29)26-15/h5-6,8,10-11,24H,1-4,9H2,(H2,26,27,28,29)
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Mal-PEG2-VCP-Eribulin
Cas Number: 2130869-18-8Formula: C70H99N7O21Molecular weight: 1374.57Synonyms: N-[3-[2-[2-(2,5-Dihydro-2,5-dioxo-1H-pyrrol-1-yl)ethoxy]ethoxy]-1-oxopropyl]-L-valyl-N5-(aminocarbon...SMILES: CC1CC2CCC3C(=C)CC(O3)CCC45CC6C(O4)C7C(O6)C(O5)C8C(O7)CCC(O8)CC(=O)CC9C(CC(C1=C)O2)OC(C9OC)CC(CNC(=O)OCC1=CC=C(C=C1)NC(=O)C(CCCNC(=O)N)NC(=O)C(C(C)C)NC(=O)CCOCCOCCN1C(=O)C=CC1=O)OInChIKey: ODAGJGZILCZEBN-LHGNNKGASA-NInChI: See more
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18-Hydroxyoctadecanoic acid
Cas Number: 3155-42-8Formula: C18H36O3Molecular weight: 300.48Synonyms: 18-hydroxyoctadecanoic acid|3155-42-8|Octadecanoic acid, 18-hydroxy-|18-hydroxy stearic acid|18-hydr...SMILES: C(CCCCCCCCC(=O)O)CCCCCCCCOInChIKey: VLHZUYUOEGBBJB-UHFFFAOYSA-NInChI: InChI=1S/C18H36O3/c19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18(20)21/h19H,1-17H2,(H,20,21)
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1,2-dioleoyl-sn-glycero-3-phosphoethanolamine-N,N-dimethyl
Cas Number: 96687-22-8Formula: C43H82NO8PMolecular weight: 772.1Synonyms: PE-NMe2(18:1(9Z)/18:1(9Z))|96687-22-8|1,2-Dioleoyl-sn-glycero-3-phosphoethanolamine-N,N-dimethyl|PE-...SMILES: CCCCCCCCC=CCCCCCCCC(=O)OCC(COP(=O)(O)OCCN(C)C)OC(=O)CCCCCCCC=CCCCCCCCCInChIKey: XHPZRQBHFOVLEJ-UNUIOPIBSA-NInChI: See more
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1,2-Dioleoyl-sn-glycero-3-phospho-L-serine sodium salt
Cas Number: 70614-14-1Formula: C42H78NO10PMolecular weight: 788Synonyms: PSer(18:1n9/18:1n9) | PS(18:1/18:1) | PS(36:02) | SCHEMBL322100 | O-[(S)-({(2r)-2,3-Bis[(9z)-Octadec...SMILES: CCCCCCCCC=CCCCCCCCC(=O)OCC(COP(=O)(O)OCC(C(=O)O)N)OC(=O)CCCCCCCC=CCCCCCCCCInChIKey: WTBFLCSPLLEDEM-JIDRGYQWSA-NInChI: See more
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(±)18-HEPE
Cas Number: 141110-17-0Formula: C20H30O3Molecular weight: 318.45Synonyms: 18-Hydroxy-5(Z),8(Z),11(Z),14(Z),16(E)-eicosapentaenoic acid | (±)-18-hydroxy-5Z,8Z,11Z,14Z,16E-eic...SMILES: CCC(C=CC=CCC=CCC=CCC=CCCCC(=O)O)OInChIKey: LRWYBGFSVUBWMO-UXNZXXPISA-NInChI: InChI=1S/C20H30O3/c1-2-19(21)17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20(22)23/h4-7,10-13,15,17,19,21H,2-3,8-9,14,16,18H2,1H3,(H,22,23)/b6-4-,7-5-,12-10-,13-11-,17-15+
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[4-(methylamino)tetrahydrofuran-3-yl]methanol
Cas Number: 1509500-18-8Formula: C6H13NO2Molecular weight: 131.17Synonyms: [4-(methylamino)oxolan-3-yl]methanol | AKOS020152678 | F89608 | 1509500-18-8SMILES: CNC1COCC1COInChIKey: DRIHZAQXFMFDFZ-UHFFFAOYSA-NInChI: InChI=1S/C6H13NO2/c1-7-6-4-9-3-5(6)2-8/h5-8H,2-4H2,1H3
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8-Methoxy-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid
Cas Number: 35975-69-0Formula: C11H9NO4Molecular weight: 219.19Synonyms: 4-hydroxy-8-methoxyquinoline-3-carboxylic acid|28027-18-1|280027-18-1|35975-69-0|8-methoxy-4-oxo-1,4...SMILES: COC1=CC=CC2=C1NC=C(C2=O)C(=O)OInChIKey: CDGYPATWKVOBIY-UHFFFAOYSA-NInChI: InChI=1S/C11H9NO4/c1-16-8-4-2-3-6-9(8)12-5-7(10(6)13)11(14)15/h2-5H,1H3,(H,12,13)(H,14,15)
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(4S)-1-oxa-8-azaspiro[3.5]nonane
Cas Number: 1527519-18-1Formula: 2[C7H13NO]·C2H2O4Molecular weight: 344.4Synonyms: SCHEMBL15958465 | (4S)-1-OXA-8-AZASPIRO[3.5]NONANE | F89473 | 1527519-18-1SMILES: C1CC2(CCO2)CNC1InChIKey: ORIDQWJOJCVWHY-ZETCQYMHSA-NInChI: InChI=1S/C7H13NO/c1-2-7(3-5-9-7)6-8-4-1/h8H,1-6H2/t7-/m0/s1
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1-O-1'-(Z)-octadecenyl-2-hydroxy-sn-glycero-3-phosphoethanolamine
Cas Number: 174062-73-8Formula: C23H48NO6PMolecular weight: 465.604Synonyms: PE(P-18:0/0:0)|1-(1Z-octadecenyl)-sn-glycero-3-phosphoethanolamine|174062-73-8|1-[(1Z)-octadec-1-eny...SMILES: CCCCCCCCCCCCCCCCC=COCC(COP(=O)(O)OCCN)OInChIKey: KACDZDULGKPXHT-HIVNOOBXSA-NInChI: InChI=1S/C23H48NO6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-28-21-23(25)22-30-31(26,27)29-20-18-24/h17,19,23,25H,2-16,18,20-22,24H2,1H3,(H,26,27)/b19-17-/t23-/m1/s1
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1-Aza-18-crown 6-Ether
Cas Number: 33941-15-0Formula: C12H25NO5Molecular weight: 263.33Synonyms: H-D-SER(TBU)-OMEHCL | J-019388 | AMY18436 | AB89914 | 1-Aza-18-crown-6 | FT-0607356 | SCHEMBL897208 ...SMILES: C1COCCOCCOCCOCCOCCN1InChIKey: NBXKUSNBCPPKRA-UHFFFAOYSA-NInChI: InChI=1S/C12H25NO5/c1-3-14-5-7-16-9-11-18-12-10-17-8-6-15-4-2-13-1/h13H,1-12H2
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tert-butyl 3-(cyanomethyl)-8-azabicyclo[3.2.1]octane-8-carboxylate
Cas Number: 1241675-18-2Formula: C14H22N2O2Molecular weight: 250.34Synonyms: 1241675-18-2 | tert-butyl 3-(cyanomethyl)-8-azabicyclo[3.2.1]octane-8-carboxylate | SCHEMBL6833708 |...SMILES: CC(C)(C)OC(=O)N1C2CCC1CC(C2)CC#NInChIKey: FEISVZRQSIPUHN-UHFFFAOYSA-NInChI: InChI=1S/C14H22N2O2/c1-14(2,3)18-13(17)16-11-4-5-12(16)9-10(8-11)6-7-15/h10-12H,4-6,8-9H2,1-3H3
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4-(3,5-Dibromophenyl)morpholine
Cas Number: 27173-18-8Formula: C10H11Br2NOMolecular weight: 321Synonyms: 4-(3,5-DIBROMOPHENYL)MORPHOLINE|27173-18-8|SCHEMBL24270121|DTXSID70682135|CBA17318|MFCD17015808|AKOS...SMILES: C1COCCN1C2=CC(=CC(=C2)Br)BrInChIKey: CIWAQOWDXYKITQ-UHFFFAOYSA-NInChI: InChI=1S/C10H11Br2NO/c11-8-5-9(12)7-10(6-8)13-1-3-14-4-2-13/h5-7H,1-4H2
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8-Methyl-6-(4-methylpiperazin-1-yl)-11h-pyrido[2,3-b][1,4]benzodiazepine
Cas Number: 147395-65-1Formula: C18H21N5Molecular weight: 307.4Synonyms: JL-18 | JL 18 | 8-methyl-6-(4-methylpiperazin-1-yl)-11h-pyrido[2,3-b][1,4]benzodiazepine | NCGC00094...SMILES: CC1=CC2=C(C=C1)NC3=C(C=CC=N3)N=C2N4CCN(CC4)CInChIKey: MMCMKWDIEUZMQB-UHFFFAOYSA-NInChI: InChI=1S/C18H21N5/c1-13-5-6-15-14(12-13)18(23-10-8-22(2)9-11-23)21-16-4-3-7-19-17(16)20-15/h3-7,12H,8-11H2,1-2H3,(H,19,20)
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5-Bromoquinolin-8-amine
Cas Number: 53472-18-7Formula: C9H7BrN2Molecular weight: 223.073Synonyms: 5-bromoquinolin-8-amine|53472-18-7|5-Bromo-quinolin-8-ylamine|5-Bromo-8-quinolinamine|8-amino-5-brom...SMILES: C1=CC2=C(C=CC(=C2N=C1)N)BrInChIKey: GEABITRRZOHARP-UHFFFAOYSA-NInChI: InChI=1S/C9H7BrN2/c10-7-3-4-8(11)9-6(7)2-1-5-12-9/h1-5H,11H2
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6-Bromo-8-methylquinoline HCl
Cas Number: 1257665-18-1Formula: C10H9BrClNMolecular weight: 258.5Synonyms: 6-Bromo-8-methylquinoline hydrochloride|1257665-18-1|6-bromo-8-methylquinoline hcl|6-bromo-8-methylq...SMILES: CC1=CC(=CC2=C1N=CC=C2)Br.ClInChIKey: WIILIZHVRUWNMP-UHFFFAOYSA-NInChI: InChI=1S/C10H8BrN.ClH/c1-7-5-9(11)6-8-3-2-4-12-10(7)8;/h2-6H,1H3;1H
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(8aS)-18-Hydroxy-8,9-diphenyl-18-oxide-diphenanthro[4,3-d:3'',4''-f][1,3,2]dioxaphosphepin
Cas Number: 871130-17-5Formula: C40H25O4PMolecular weight: 600.6SMILES: C1=CC=C(C=C1)C2=C3C4=C(C=C5C=CC6=CC=CC=C6C5=C4OP(=O)(OC3=C7C(=C2)C=CC8=CC=CC=C87)O)C9=CC=CC=C9InChIKey: YKIJNEDTUDPMNC-UHFFFAOYSA-NInChI: InChI=1S/C40H25O4P/c41-45(42)43-39-35-29(21-19-27-15-7-9-17-31(27)35)23-33(25-11-3-1-4-12-25)37(39)38-34(26-13-5-2-6-14-26)24-30-22-20-28-16-8-10-18-32(28)36(30)40(38)44-45/h1-24H,(H,41,42)
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Microcystin LR, desmethyl ("Asp3-MCLR")
Cas Number: 120011-66-7Formula: C48H72N10O12Molecular weight: 981.14Synonyms: (5R,8S,11R,15S,18S,19S,22R)-15-[3-(diaminomethylideneamino)propyl]-18-[(1E,3E,5S,6S)-6-methoxy-3,5-d...SMILES: CC1C(NC(=O)C(NC(=O)CC(NC(=O)C(NC(=O)C(NC(=O)C(=C)N(C(=O)CCC(NC1=O)C(=O)O)C)C)CC(C)C)C(=O)O)CCCN=C(N)N)C=CC(=CC(C)C(CC2=CC=CC=C2)OC)CInChIKey: VYEBKSHVYPDMQQ-MREVJOSWSA-NInChI: See more
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8-Methyl-8-azabicyclo[3.2.1]oct-3-ene
Cas Number: 529-18-0Formula: C8H13NMolecular weight: 123.2Synonyms: 8-methyl-8-azabicyclo[3.2.1]oct-3-ene|529-18-0|8-Methyl-8-azabicyclo[3.2.1]oct-2-ene|Tropidin|8-Meth...SMILES: CN1C2CCC1C=CC2InChIKey: RNHFKJBXKFGPIY-UHFFFAOYSA-NInChI: InChI=1S/C8H13N/c1-9-7-3-2-4-8(9)6-5-7/h2-3,7-8H,4-6H2,1H3
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8-bromo-3-fluoro-naphthalene-1-carboxylic acid
Cas Number: 2387597-18-2Formula: C11H6O2FBrMolecular weight: 269.07Synonyms: 2387597-18-2 | 8-bromo-3-fluoro-naphthalene-1-carboxylic acid | 8-Bromo-3-fluoro-1-naphthoic acid | ...SMILES: C1=CC2=CC(=CC(=C2C(=C1)Br)C(=O)O)FInChIKey: ALFLHWGSJSYYIT-UHFFFAOYSA-NInChI: InChI=1S/C11H6BrFO2/c12-9-3-1-2-6-4-7(13)5-8(10(6)9)11(14)15/h1-5H,(H,14,15)
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Microcystin-LA
Cas Number: 96180-79-9Formula: C46H67N7O12Molecular weight: 910.06Synonyms: Cyanogynosin-LA | (5R,8S,11R,12S,15S,18S,19S,22R)-18-[(1E,3E,5S,6S)-6-methoxy-3,5-dimethyl-7-phenylh...SMILES: CC1C(NC(=O)C(NC(=O)C(C(NC(=O)C(NC(=O)C(NC(=O)C(=C)N(C(=O)CCC(NC1=O)C(=O)O)C)C)CC(C)C)C(=O)O)C)C)C=CC(=CC(C)C(CC2=CC=CC=C2)OC)CInChIKey: DIAQQISRBBDJIM-DRSCAGMXSA-NInChI: See more
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2,3,7,8,12,13,17,18-Octaethylporphyrin
Cas Number: 2683-82-1Formula: C36H46N4Molecular weight: 534.79Synonyms: Octaethylporphine | 2,3,7,8,12,13,17,18-octaethylporphyrin | 2,3,7,8,12,13,17,18-Octaethyl-21H,23H-p...SMILES: CCC1=C(C2=CC3=NC(=CC4=NC(=CC5=C(C(=C(N5)C=C1N2)CC)CC)C(=C4CC)CC)C(=C3CC)CC)CCInChIKey: XFIIGRBIXXECHR-UHFFFAOYSA-NInChI: InChI=1S/C36H46N4/c1-9-21-22(10-2)30-18-32-25(13-5)26(14-6)34(39-32)20-36-28(16-8)27(15-7)35(40-36)19-33-24(12-4)23(11-3)31(38-33)17-29(21)37-30/h17-20,37-38H,9-16H2,1-8H3
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