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LumiflavineCas Number: 1088-56-8 EC Number: 214-125-5Formula: C13H12N4O2 Molecular Weight: 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: InChI=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)Synonyms: 7,8,10-trimethyl-2H,3H,4H,10H-benzo[g]pteridine-2,4-dione | 7,8,10-Trimethylbenzo(g)pteridine-2,4,(3H,10H)-dione | BE...
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RO4929097, Gamma-secretase inhibitorCas Number: 847925-91-1 Compound CID: 49867930Formula: C22H20F5N3O3 Molecular Weight: 469.4IUPAC Name: 2,2-dimethyl-N-[(7S)-6-oxo-5,7-dihydrobenzo[d][1]benzazepin-7-yl]-N'-(2,2,3,3,3-pentafluoropropyl)propanediamideSMILES: CC(C)(C(=O)NCC(C(F)(F)F)(F)F)C(=O)NC1C2=CC=CC=C2C3=CC=CC=C3NC1=OInChIKey: OJPLJFIFUQPSJR-INIZCTEOSA-NInChI: show more
Synonyms: NCGC00263162-01 | Propanediamide, N-((7S)-6,7-dihydro-6-oxo-5H-dibenz(b,d)azepin-7-yl)-2,2-dimethyl-N'-(2,2,3,3,3-pen... -
Procyanidin B2 3,3′-di-O-gallateCas Number: 79907-44-1 Compound CID: 124016Formula: C44H34O20 Molecular Weight: 882.73IUPAC Name: show 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: show more Synonyms: CHEBI:172846 | Procyanidin B2 3,3'-di-O-gallate | 3,3'-Digalloylprocyanidin B2 | Proanthocyanidin B2 3,3'-O-gallate |...
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Carvacrol, Channel blocker of TRPM7;Activator of TRPV3Cas Number: 499-75-2 EC Number: 207-889-6Formula: C10H14O Molecular Weight: 150.22IUPAC Name: 2-methyl-5-propan-2-ylphenolSMILES: CC1=C(C=C(C=C1)C(C)C)OInChIKey: RECUKUPTGUEGMW-UHFFFAOYSA-NInChI: InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)10(11)6-9/h4-7,11H,1-3H3Synonyms: 2-methyl-5-propan-2-ylphenol | 2-methyl-5-propan-2-yl-phenol | AKOS000120828 | F8889-1978 | MB00118 | Oxycymol | 9B1J...
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Valproic acid, Inhibitor of histone deacetylase 1Formula: C8H16O2 Molecular Weight: 144.21IUPAC Name: 2-propylpentanoic acidSMILES: CCCC(CCC)C(=O)OInChIKey: NIJJYAXOARWZEE-UHFFFAOYSA-NInChI: InChI=1S/C8H16O2/c1-3-5-7(6-4-2)8(9)10/h7H,3-6H2,1-2H3,(H,9,10)Synonyms: Depakene | Depakin chrono | EC 202-777-3 | VALPROIC ACID | VALPROIC ACID [EP MONOGRAPH] | (n-C3H7)2CHCOOH | Nu-Valpro...
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LY-411575Cas Number: 209984-57-6Formula: C26H23F2N3O4 Molecular Weight: 479.48IUPAC Name: (2S)-2-[[(2S)-2-(3,5-difluorophenyl)-2-hydroxyacetyl]amino]-N-[(7S)-5-methyl-6-oxo-7H-benzo[d][1]benzazepin-7-yl]propanamideSMILES: CC(C(=O)NC1C2=CC=CC=C2C3=CC=CC=C3N(C1=O)C)NC(=O)C(C4=CC(=CC(=C4)F)F)OInChIKey: ULSSJYNJIZWPSB-CVRXJBIPSA-NInChI: show more Synonyms: AC-32717 | LY 411,575 | N(2)-[(2S)-2-(3,5-difluorophenyl)-2-hydroxyacetyl]-N-[(7S)-5-methyl-6-oxo-6,7-dihydro-5H-dibe...
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PsoralidinCas Number: 18642-23-4 Compound CID: 5281806Formula: C20H16O5 Molecular Weight: 336.34IUPAC Name: 3,9-dihydroxy-2-(3-methylbut-2-enyl)-[1]benzofuro[3,2-c]chromen-6-oneSMILES: CC(=CCC1=CC2=C(C=C1O)OC(=O)C3=C2OC4=C3C=CC(=C4)O)CInChIKey: YABIJLLNNFURIJ-UHFFFAOYSA-NInChI: InChI=1S/C20H16O5/c1-10(2)3-4-11-7-14-17(9-15(11)22)25-20(23)18-13-6-5-12(21)8-16(13)24-19(14)18/h3,5-9,21-22H,4H2,1-2H3Synonyms: 3,9-dihydroxy-2-(3-methylbut-2-en-1-yl)-6H-[1]benzofuro[3,2-c][1]benzopyran-6-one | UNII-G16ZUQ069L | BDBM246524 | HY...
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DAPTCas Number: 208255-80-5Formula: C23H26F2N2O4 Molecular Weight: 432.46IUPAC Name: tert-butyl (2S)-2-[[(2S)-2-[[2-(3,5-difluorophenyl)acetyl]amino]propanoyl]amino]-2-phenylacetateSMILES: CC(C(=O)NC(C1=CC=CC=C1)C(=O)OC(C)(C)C)NC(=O)CC2=CC(=CC(=C2)F)FInChIKey: DWJXYEABWRJFSP-XOBRGWDASA-NInChI: show more Synonyms: Glycine, N-[2-(3,5-difluorophenyl)acetyl]-L-alanyl-2-phenyl-, 1,1-dimethylethyl ester, (2S)- | MRF-0000012 | (S)-tert...
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N,N′-Hexamethylene bis(acetamide)Cas Number: 3073-59-4Formula: C10H20N2O2 Molecular Weight: 200.28IUPAC Name: N-(6-acetamidohexyl)acetamideSMILES: CC(=O)NCCCCCCNC(=O)CInChIKey: BNQSTAOJRULKNX-UHFFFAOYSA-NInChI: InChI=1S/C10H20N2O2/c1-9(13)11-7-5-3-4-6-8-12-10(2)14/h3-8H2,1-2H3,(H,11,13)(H,12,14)Synonyms: MLS000069460 | N,N'-Hexamethylene bis(acetamide), 98% | HMS2231F06 | diacetyldiaminohexane | FT-0629398 | N,N'-1,6-He...
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Avagacestat, Gamma-secretase inhibitorCas Number: 1146699-66-2Formula: C20H17ClF4N4O4S Molecular Weight: 520.89IUPAC Name: (2R)-2-[(4-chlorophenyl)sulfonyl-[[2-fluoro-4-(1,2,4-oxadiazol-3-yl)phenyl]methyl]amino]-5,5,5-trifluoropentanamideSMILES: C1=CC(=CC=C1S(=O)(=O)N(CC2=C(C=C(C=C2)C3=NOC=N3)F)C(CCC(F)(F)F)C(=O)N)ClInChIKey: XEAOPVUAMONVLA-QGZVFWFLSA-NInChI: show more Synonyms: DB11893 | (2R)-2-[(4-chlorophenyl)sulfonyl-[[2-fluoro-4-(1,2,4-oxadiazol-3-yl)phenyl]methyl]amino]-5,5,5-trifluoropen...
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Sodium 2-Propylvalerate, Succinate semialdehyde dehydrogenase inhibitorCas Number: 1069-66-5 Compound CID: 16760703Formula: C8H15NaO2 Molecular Weight: 166.2IUPAC Name: sodium;2-propylpentanoateSMILES: CCCC(CCC)C(=O)[O-].[Na+]InChIKey: AEQFSUDEHCCHBT-UHFFFAOYSA-MInChI: InChI=1S/C8H16O2.Na/c1-3-5-7(6-4-2)8(9)10;/h7H,3-6H2,1-2H3,(H,9,10);/q;+1/p-1Synonyms: UNII-5VOM6GYJ0D | Valeric acid, 2-propyl-, sodium salt | VALPROATE SODIUM [WHO-DD] | 2-Propylpentanoic acid sodium sa...
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Avagacestat, Gamma-secretase inhibitorCas Number: 1146699-66-2Formula: C20H17ClF4N4O4S Molecular Weight: 520.89IUPAC Name: (2R)-2-[(4-chlorophenyl)sulfonyl-[[2-fluoro-4-(1,2,4-oxadiazol-3-yl)phenyl]methyl]amino]-5,5,5-trifluoropentanamideSMILES: C1=CC(=CC=C1S(=O)(=O)N(CC2=C(C=C(C=C2)C3=NOC=N3)F)C(CCC(F)(F)F)C(=O)N)ClInChIKey: XEAOPVUAMONVLA-QGZVFWFLSA-NInChI: show more Synonyms: DB11893 | (2R)-2-[(4-chlorophenyl)sulfonyl-[[2-fluoro-4-(1,2,4-oxadiazol-3-yl)phenyl]methyl]amino]-5,5,5-trifluoropen...
