Benzopiranos
3-Isocromanona, Thermo Scientific Chemicals
CAS: 4385-35-7 Fórmula molecular: C9H8O2 Peso molecular (g/mol): 148.16 Clave InChI: ILHLUZUMRJQEAH-UHFFFAOYSA-N Nombre IUPAC: 3,4-dihidro-1H-2-benzopirano-3-ona SMILES: O=C1CC2=CC=CC=C2CO1
Citrinina, MP Biomedicals™
CAS: 518-75-2 Fórmula molecular: C13H14O5 Peso molecular (g/mol): 250.25 Clave InChI: CBGDIJWINPWWJW-IYSWYEEDSA-N Sinónimo: citrinin,antimycin,--citrinin,citriain,3r,4s-4,6-dihydro-8-hydroxy-3,4,5-trimethyl-6-oxo-3h-2-benzopyran-7-carboxylic acid,unii-3s697x6snz,ccris 175,3h-2-benzopyran-7-carboxylic acid, 4,6-dihydro-8-hydroxy-3,4,5-trimethyl-6-oxo-, 3r-trans,3r-trans-4,6-dihydro-8-hydroxy-3,4,5-trimethyl-6-oxo-3h-2-benzopyran-7-carboxylic acid,4,6-dihydro-8-hydroxy-3,4,5-trimethyl-6-oxo-3h-2-benzopyran-7-carboxylic acid PubChem CID: 54680783 Nombre IUPAC: Ácido (3R,4S)-6-hidroxi-3,4,5-trimetil-8-oxo-3,4-dihidroisocromeno-7-carboxílico SMILES: CC1C(OC=C2C1=C(C(=C(C2=O)C(=O)O)O)C)C
Nebivolol, TRC
CAS: 99200-09-6 Fórmula molecular: C22H25F2NO4 Peso molecular (g/mol): 405.44 Sinónimo: α,α'-[Iminobis(methylene)]bis[6-fluoro-3,4-dihydro-2H-1-benzopyran-2-methanol]; Nombre IUPAC: 1-(6-fluoro-3,4-dihidro-2H-cromeno-2-il)-2-[[2-(6-fluoro-3,4-dihidro-2H-cromeno-2-il)-2-hidroxietil]amino]etanol SMILES: FC1=CC=C2C(CCC(C(O)CNCC(O)C3CCC4=CC(F)=CC=C4O3)O2)=C1
Diacetilfluoresceína, TRC
CAS: 596-09-8 Fórmula molecular: C24 H16 O7 Peso molecular (g/mol): 416.38 Sinónimo: Fluorescein diacetate,Diacetylfluorescein,3',6'-Bis(acetyloxy)spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one Nombre IUPAC: (6'-acetiloxi-3-oxospiro[2-benzofuran-1,9'-xanten]-3'-il) acetato SMILES: CC(=O)Oc1ccc2c(Oc3cc(OC(=O)C)ccc3C24OC(=O)c5ccccc45)c1
1-Pentadecanettiol, TRC
CAS: 25276-70-4 Fórmula molecular: C15H32S Peso molecular (g/mol): 244.48 Nombre IUPAC: Pentadescano-1-tiol SMILES: CCCCCCCCCCCCCCCS
Fluoresceína 5-isotiocianato, isómero 1, 95%, TRC
CAS: 3326-32-7 Fórmula molecular: C21 H11 N O5 S Peso molecular (g/mol): 389.38 Sinónimo: FITC Nombre IUPAC: 3',6'-dihidroxi-6-isotiocianatospiro[2-benzofurano-3,9'-xanten]-1-ona SMILES: Oc1ccc2c(Oc3cc(O)ccc3C24OC(=O)c5cc(ccc45)N=C=S)c1
Zinpyr-1, TRC
CAS: 288574-78-7 Fórmula molecular: C46 H36 Cl2 N6 O5 Peso molecular (g/mol): 823.72 Nombre IUPAC: 2-[4,5-bis[[bis(piridina-2-ilmetil)amino]metilo]-2,7-dicloro-3-hidroxi-6-oxxantano-9-il]ácido benzoico SMILES: OC(=O)c1ccccc1C2=C3C=C(Cl)C(=O)C(=C3Oc4c(CN(Cc5ccccn5)Cc6ccccn6)c(O)c(Cl)cc24)CN(Cc7ccccn7)Cc8ccccn8
Vadimezan, TRC
CAS: 117570-53-3 Fórmula molecular: C17H14O4 Peso molecular (g/mol): 282.29 Sinónimo: 2-(5,6-Dimethyl-9-oxo-9H-xanthen-4-yl)acetic Acid,5,6-Dimethyl-9-oxo-9H-xanthen-4-ylacetic Acid,5,6-Dimethylxanthenone-4-acetic Acid,AS 1404,ASA 404,DMXAA,NSC 640488,5,6-Dimethyl-9-oxo-9H-xanthene-4-acetic Acid Nombre IUPAC: Ácido acético 2-(5,6-dimetil-9-oxoxantano-4-il)acético SMILES: Cc1ccc2C(=O)c3cccc(CC(=O)O)c3Oc2c1C
Floxina B, TRC
CAS: 18472-87-2 Fórmula molecular: C20 H2 Br4 Cl4 O5 . 2 Na Peso molecular (g/mol): 829.63 Sinónimo: Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one, 2',4',5',7'-tetrabromo-4,5,6,7-tetrachloro-3',6'-dihydroxy-, sodium salt (1:2),Fluorescein, 2',4',5',7'-tetrabromo-4,5,6,7-tetrachloro-, disodium salt (8CI),Phloxin B (6CI),Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one, 2',4',5',7'-tetrabromo-4,5,6,7-tetrachloro-3',6'-dihydroxy-, disodium salt (9CI),11969 Red,3427 Veri Pur Pink,Acid Red 92,Aizen Acid Phloxine PB,C.I. 45410,C.I. Acid Red 92,Cyanosin,Cyanosin (acid dye),Cyanosin B,Cyanosine,D and C Red No. 28,D&C Red 28,D&C Red 28-308267,D&C Red No. 28,D&C Red No. 28-15347,D&C Red No. 28-38015,Daiwa Red 104WB,Daiwa Red 45,DermaGlo DG-R 428,Disodium 9-(3',4',5',6'-tetrachloro-o-carboxyphenyl)-6-hydroxy-6-hydroxy-2,4,5,7-tetrabromo-3-isoxanthone,Eosin blue,Eosin bluish,Eosine blue,Eosine bluish,Food Red 104,Food Red No. 104,Japan Red 104,Japan Red 104-1,Japan Red No. 104-1,Orient Water Pink 2,Phloxine B,Phloxine B 38015,Phloxine P,Phyloxine B,Red 104,Red No. 104,Red No.104-1,Triacid Floxine 2G,Water Pink 2 Nombre IUPAC: disodio; 2',4',5',7'-tetrabromo-4,5,6,7-tetracloro-3-oxespiridor[2-benzofurano-1,9'-xanteno]-3',6'-diolato SMILES: [Na+].[Na+].[O-]c1c(Br)cc2c(Oc3c(Br)c([O-])c(Br)cc3C24OC(=O)c5c(Cl)c(Cl)c(Cl)c(Cl)c45)c1Br
gamma-CEHC, TRC
CAS: 178167-75-4 Fórmula molecular: C15H20O4 Peso molecular (g/mol): 264.32 Sinónimo: 3,4-Dihydro-6-hydroxy-2,7,8-trimethyl-2H-1-benzopyran-2-propanoic Acid,(±)-LLU-α,2,7,8-Trimethyl-2-(β-carboxyethyl)-6-hydroxychroman,Racemic LLU-α Nombre IUPAC: ácido 3-(6-hidroxi-2,7,8-trimetil-3,4-dihidrocromeno-2-il)propanoico SMILES: OC(=O)CCC1(C)CCc2cc(O)c(C)c(C)c2O1
N-Nitroso Nebivolol (mezcla de diastereómeros), TRC
CAS: 1391051-68-5 Fórmula molecular: C22 H24 F2 N2 O5 Peso molecular (g/mol): 434.43 Sinónimo: N,N-Bis[2-(6-fluorochroman-2-yl)-2-hydroxyethyl]nitrous amide,N,N-Bis[2-(6-fluorochroman-2-yl)-2-hydroxyethyl]nitrous amide Nombre IUPAC: N,N-bis[2-(6-fluoro-3,4-dihidro-2H-cromen-2-il)-2-hidroxietilamida nitrosa SMILES: OC(CN(CC(O)C1CCc2cc(F)ccc2O1)N=O)C3CCc4cc(F)ccc4O3
rac Galaxolidona (Mezcla de Diastereomeros), TRC
CAS: 507442-49-1 Fórmula molecular: C18H24O2 Peso molecular (g/mol): 272.38 Sinónimo: 4,6,7,8-Tetrahydro-4,6,6,7,8,8-hexamethyl-cyclopenta[g]-2-benzopyran-1(3H)-one Nombre IUPAC: 4,6,6,7,8,8-hexametil-4,7-dihidro-3H-ciclopenta[g]isocromo-1-una SMILES: O=C1OCC(C)C2=CC3=C(C(C)(C)C(C)C3(C)C)C=C21
rac Nebivolol Hidrocloruro, TRC
CAS: 169293-50-9 Fórmula molecular: C22 H25 F2 N O4 . Cl H Peso molecular (g/mol): 441.9 Sinónimo: 2H-1-Benzopyran-2-methanol, α,α'-[iminobis(methylene)]bis[6-fluoro-3,4-dihydro-, hydrochloride (1:1),2H-1-Benzopyran-2-methanol, α,α'-[iminobis(methylene)]bis[6-fluoro-3,4-dihydro-, hydrochloride (9CI) Nombre IUPAC: 1-(6-fluoro-3,4-dihidro-2H-cromeno-2-il)-2-[[2-(6-fluoro-3,4-dihidro-2H-cromo-2-il)-2-hidroxietil]amino]etanol; Cloruro SMILES: Cl.OC(CNCC(O)C1CCc2cc(F)ccc2O1)C3CCc4cc(F)ccc4O3