Hydroxy acids and derivatives
Dibutyl Maleate, TRC
CAS: 105-76-0 Molecular Formula: C12 H20 O4 Molecular Weight (g/mol): 228.28 Synonym: 2-Butenedioic acid (2Z)-, dibutyl ester (9CI),2-Butenedioic acid (Z)-, dibutyl ester,Maleic acid, dibutyl ester (6CI,8CI),Butyl maleate,DBM,Di-n-butyl maleate,Dibutyl maleate,Maleic acid di-n-butyl ester,RC Comonomer DBM,Staflex DBM,Vinavil CF 5 IUPAC Name: dibutyl (Z)-but-2-enedioate SMILES: CCCCOC(=O)\C=C/C(=O)OCCCC
Choline Bitartrate, TRC
CAS: 87-67-2 Molecular Formula: C5 H14 N O . C4 H5 O6 Molecular Weight (g/mol): 253.25 Synonym: Choline tartrate (6CI),Choline, hydrogen tartrate (7CI),Choline, tartrate (1:1) (salt) (8CI),Ethanaminium, 2-hydroxy-N,N,N-trimethyl-, salt with (2R,3R)-2,3-dihydroxybutanedioic acid (1:1) (9CI),Ethanaminium, 2-hydroxy-N,N,N-trimethyl-, salt with [R-(R*,R*)]-2,3-dihydroxybutanedioic acid (1:1),Butanedioic acid, 2,3-dihydroxy- (2R,3R)-, ion(1-), 2-hydroxy-N,N,N-trimethylethanaminium (9CI),Butanedioic acid, 2,3-dihydroxy-[R-(R*,R*)]-, ion(1-), 2-hydroxy-N,N,N-trimethylethanaminium,Tartaric acid, ion(1-), choline (8CI),(2-Hydroxyethyl)trimethylammonium bitartrate,Choline bitartrate IUPAC Name: 2-hydroxyethyl(trimethyl)azanium;(2R,3R)-2,3,4-trihydroxy-4-oxobutanoate SMILES: C[N+](C)(C)CCO.O[C@H]([C@@H](O)C(=O)[O-])C(=O)O
Tropic Acid, TRC
CAS: 552-63-6 Molecular Formula: C9 H10 O3 Molecular Weight (g/mol): 166.17 Synonym: (2RS)-3-Hydroxy-2-phenylpropanoic Acid,dl-Tropic Acid,Tropic Acid,Ipratropium Bromide Imp. C (EP),Hyoscyamine Sulphate Imp. A (EP),Hyoscine Butylbromide Imp. B (EP),Tropicamide Imp. C (EP),Hyoscine Hydrobromide Imp. D (EP),Atropine Imp. C (EP),(±)-α-(Hydroxymethyl)benzeneacetic acid,(±)-2-Phenyl-3-hydroxypropionic acid,(±)-3-Hydroxy-2-phenylpropionic acid,(±)-Tropic acid,2-Phenyl-3-hydroxypropanoic acid,2-Phenyl-3-hydroxypropionic acid,2-Phenylhydracrylic acid,3-Hydroxy-2-phenylpropionic acid,DL-Tropic acid,NSC 20990,α-(Hydroxymethyl)benzeneacetic acid IUPAC Name: 3-hydroxy-2-phenylpropanoic acid SMILES: OCC(C(=O)O)c1ccccc1
Nor Scopolamine, TRC
CAS: 4684-28-0 Molecular Formula: C16 H19 N O4 Molecular Weight (g/mol): 289.33 Synonym: Benzeneacetic acid, α-(hydroxymethyl)-, (1α,2β,4β,5α,7β)-3-oxa-9-azatricyclo[3.3.1.02,4]non-7-yl ester, (αS)-,1αH,5αH-Nortropan-3α-ol, 6β,7β-epoxy-, (-)-tropate (ester) (8CI),Benzeneacetic acid, α-(hydroxymethyl)-, 3-oxa-9-azatricyclo[3.3.1.02,4]non-7-yl ester, [7(S)-(1α,2β,4β,5α,7β)]-,Norscopolamine (7CI),Norhyoscine SMILES: OC[C@@H](C(=O)O[C@H]1C[C@@H]2N[C@H](C1)[C@H]3O[C@@H]23)c4ccccc4
3-Hydroxynonanoic Acid, TRC
CAS: 40165-87-5 Molecular Formula: C9 H18 O3 Molecular Weight (g/mol): 174.24 Synonym: (+/-)-3-Hydroxynonanoic Acid,3-Hydroxynonanoic Acid,β-Hydroxynonanoic Acid IUPAC Name: 3-hydroxynonanoic acid SMILES: CCCCCCC(O)CC(=O)O
10-Hydroxydecanoic Acid, TRC
CAS: 1679-53-4 Molecular Formula: C10 H20 O3 Molecular Weight (g/mol): 188.264 Synonym: E-10-Hydroxy-2-decylennic Acid,NSC 15139 IUPAC Name: 10-hydroxydecanoic acid SMILES: OCCCCCCCCCC(=O)O
3-Hydroxydodecanedioic Acid, TRC
CAS: 34574-69-1 Molecular Formula: C12H22O5 Molecular Weight (g/mol): 246.3 SMILES: O=C(O)CC(O)CCCCCCCCC(O)=O
alpha-Methylglyceric Acid, TRC
CAS: 21620-60-0 Molecular Formula: C4H8O4 Molecular Weight (g/mol): 120.1 Synonym: 2,3-Dihydroxy-2-methylpropanoic Acid,2,3-Dihydroxy-2-methylpropionic Acid,2-C-Methylglyceric Acid,2-Methyl-2,3-dihydroxypropionic Acid,2-Methylglyceric Acid,2-Methylglyceronic Acid,α,β-Dihydroxyisobutyric Acid SMILES: Cl.OCC1C(O)C(O)C(N)C(O)O1
N-Butylscopolammonium Bromide, TRC
CAS: 149-64-4 Molecular Formula: C21 H30 N O4 . Br Molecular Weight (g/mol): 440.37 Synonym: Hyoscine Butylbromide,(1α,2β,4β,5α,7β)-9-Butyl-7-[(2S)-3-hydroxy-1-oxo-2-phenylpropoxy]-9-methyl-3-Oxa-9-azoniatricyclo[3.3.1.02,4]nonane bromide (1:1),8-Butyl-6β,7β-epoxy-3α-hydroxy-1αH,5αH-tropanium bromide (-)-tropate,[7(S)-(1α,2β,4β,5α,7β)]-9-Butyl-7-(3-hydroxy-1-oxo-2-phenylpropoxy)-9-methyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonane bromide,N-Butylscopolammonium bromide,(-)-Tropic acid ester with 8-butyl-6β,7β-epoxy-3α-hydroxy-1αH,5αH-tropanium bromide,(-)-Scopolamine butylbromide,Amisepan,Buscapine,Buscol,Buscolamin,Buscolysin,Buscolysine,Buscopan,Butylmin,Butylscopolamine bromide,Butylscopolammonium bromide,Donopon,Hyoscine butobromide,Hyoscine butyl bromide,Joscine,Monospan,N-Butylhyoscine bromide,N-Butylhyoscinium bromide,N-Butylscopolamine bromide,N-Butylscopolaminium bromide,Scobro,Scobron,Scobutil,Scobutyl,Scopolamine bromobutylate,Scopolamine butobromide,Scopolamine butyl bromide,Scopolamine-N-butyl bromide,Scopolan,Sparicon,Sporamin,Sporamin (pharmaceutical),Stibron,Tirantil IUPAC Name: (1α,2β,4β,5α,7β)-9-Butyl-7-[(2S)-3-hydroxy-1-oxo-2-phenylpropoxy]-9-methyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonane bromide SMILES: [Br-].CCCC[N@@+]1(C)[C@@H]2C[C@H](C[C@H]1[C@@H]3O[C@H]23)OC(=O)[C@H](CO)c4ccccc4
DL-Malic Acid, TRC
CAS: 6915-15-7 Molecular Formula: C4 H6 O5 Molecular Weight (g/mol): 134.09 Synonym: Malic acid,(2RS)-2-Hydroxybutanedioic acid,Butanedioic acid, hydroxy- (9CI),Malic acid (8CI),(±)-Malic acid,2-Hydroxybutanedioic acid,2-Hydroxyethane-1,2-dicarboxylic acid,2-Hydroxysuccinic acid,DL-Malic acid,Deoxytetraric acid,E 296,FDA 2018,Hydroxybutanedioic acid,Hydroxysuccinic acid,Musashi-no-Ringosan,NSC 25941,Nanoveson M,Pomalus Acid,R,S(±)-Malic acid,Xeros,dl-Malic acid,α-Hydroxysuccinic acid IUPAC Name: 2-hydroxybutanedioic acid SMILES: OC(CC(=O)O)C(=O)O
3-Hydroxyhexanedioic Acid, TRC
CAS: 14292-29-6 Molecular Formula: C6 H10 O5 Molecular Weight (g/mol): 162.14 Synonym: Hexanedioic acid, 3-hydroxy-,3-Hydroxyhexanedioic acid,3-Hydroxyadipic acid,β-Hydroxyadipic acid IUPAC Name: 3-hydroxyhexanedioic acid SMILES: OC(CCC(=O)O)CC(=O)O
Methyl 3-Hydroxybutyrate, TRC
CAS: 1487-49-6 Molecular Formula: C5H10O3 Molecular Weight (g/mol): 118.13 Synonym: Butyric acid, 3-hydroxy-, methyl ester (6CI,7CI,8CI),(±)-Methyl 3-hydroxybutanoate,3-Hydroxybutyric acid methyl ester,Methyl (RS)-3-hydroxybutyrate,Methyl 3-hydroxybutanoate,Methyl beta-hydroxybutyrate IUPAC Name: methyl 3-hydroxybutanoate SMILES: COC(=O)CC(C)O
Pravastatin 1,1,3,3-Tetramethylbutylamine, TRC
CAS: 151006-14-3 Molecular Formula: C23 H36 O7 . C8 H19 N Molecular Weight (g/mol): 553.77 Synonym: Pravastatin 1,1,3,3-Tetramethylbutylamine,1-Naphthaleneheptanoic acid, 1,2,6,7,8,8a-hexahydro-β,δ,6-trihydroxy-2-methyl-8-(2-methyl-1-oxobutoxy)-, [1S-[1α(βS*,δS*),2α,6α,8β(R*),8aα]]-, compd. with 2,4,4-trimethyl-2-pentanamine (1:1) (9CI),2-Pentanamine, 2,4,4-trimethyl-, [1S-[1α(βS*,δS*),2α,6α,8β(R*),8aα]]-1,2,6,7,8,8a-hexahydro-β,δ,6-trihydroxy-2-methyl-8-(2-methyl-1-oxobutoxy)-1-naphthaleneheptanoate (9CI) IUPAC Name: (3R,5R)-7-[(1S,2S,6S,8S,8aR)-6-hydroxy-2-methyl-8-[(2S)-2-methylbutanoyl]oxy-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-dihydroxyheptanoic acid;2,4,4-trimethylpentan-2-amine SMILES: CC[C@H](C)C(=O)O[C@H]1C[C@H](O)C=C2C=C[C@H](C)[C@H](CC[C@@H](O)C[C@@H](O)CC(=O)O)[C@@H]12.CC(C)(C)CC(C)(C)N
Hyoscine Hydrobromide Trihydrate, TRC
CAS: 6533-68-2 Molecular Formula: C17 H21 N O4 . Br H . 3 H2 O Molecular Weight (g/mol): 438.31 Synonym: Hyoscine Hydrobromide Trihydrate,Hyoscyamine Sulphate Imp. D (EP) as Hydrobromide Trihydrate,Hyoscine Butylbromide Imp. A (EP) as Hydrobromide Trihydrate,Atropine Imp. F (EP) as Hydrobromide Trihydrate,(αS)-α-(Hydroxymethyl)benzeneacetic acid (1α,2β,4β,5α,7β)-9-methyl-3-oxa-9-azatricyclo[3.3.1.02, ́]non-7-yl ester hydrobromide hydrate (1:1:3),(αS)-α-(Hydroxymethyl)benzeneacetic acid (1α,2β,4β,5α,7β)-9-methyl-3-oxa-9-azatricyclo[3.3.1.02, ́]non-7-yl ester hydrobromide trihydrate,α-(Hydroxymethyl)benzeneacetic acid [7(S)-(1α,2β,4β,5α,7β)]-9-methyl-3-oxa-9-azatricyclo[3.3.1.02, ́]non-7-yl ester hydrobromide trihydrate,3-Oxa-9-azatricyclo[3.3.1.02, ́]nonane benzeneacetic acid deriv.,(-)-Scopolamine hydrobromide trihydrate,Hyoscine hydrobromide trihydrate,Scopolamine hydrobromide trihydrate IUPAC Name: [(1R,2R,4S,5S)-9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-7-yl] (2S)-3-hydroxy-2-phenylpropanoate;trihydrate;hydrobromide SMILES: O.O.O.Br.CN1[C@@H]2C[C@H](C[C@H]1[C@@H]3O[C@H]23)OC(=O)[C@H](CO)c4ccccc4
2-Hydroxydecanedioic Acid, TRC
CAS: 103963-71-9 Molecular Formula: C10H18O5 Molecular Weight (g/mol): 218.25 Synonym: alpha-Hydroxysebacic Acid IUPAC Name: 2-hydroxydecanedioic acid SMILES: OC(CCCCCCCC(=O)O)C(=O)O