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Fatty acid esters
Description:
Carboxylic ester derivatives of a fatty acid.
Ancestors:
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Eicosanoic acid，1-methylethyl esterCas Number: 26718-90-1Formula: C23H46O2 Molecular Weight: 354.6101SMILES: CCCCCCCCCCCCCCCCCCCC(=O)OC(C)CInChIKey: WLMTYYBAGSMBPQ-UHFFFAOYSA-NInChI: InChI=1S/C23H46O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23(24)25-22(2)3/h22H,4-21H2,1-3H3 -
Butanedioic acid， tetramethyl-， dimethyl esterCas Number: 17072-58-1Formula: C10H18O4 Molecular Weight: 202.2475SMILES: CC(C)(C(=O)OC)C(C)(C)C(=O)OCInChIKey: JMAVQGUNDSXRMY-UHFFFAOYSA-NInChI: InChI=1S/C10H18O4/c1-9(2,7(11)13-5)10(3,4)8(12)14-6/h1-6H3
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Butanoic acid， 2-ethyl-2-methyl-， ethyl esterCas Number: 19945-14-3Formula: C9H18O2 Molecular Weight: 158.238SMILES: CCC(C)(CC)C(=O)OCCInChIKey: NPNMNANLCUXXQR-UHFFFAOYSA-NInChI: InChI=1S/C9H18O2/c1-5-9(4,6-2)8(10)11-7-3/h5-7H2,1-4H3
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2-hydroxypropyl 2-ethylhexanoateCas Number: 58921-10-1 Compound CID: 23497921Formula: C11H22O3 Molecular Weight: 202.29IUPAC Name: 2-hydroxypropyl 2-ethylhexanoateSMILES: CCCCC(CC)C(=O)OCC(C)OInChIKey: RCYYLBZELJCFBT-UHFFFAOYSA-NInChI: InChI=1S/C11H22O3/c1-4-6-7-10(5-2)11(13)14-8-9(3)12/h9-10,12H,4-8H2,1-3H3
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17-methyl Stearic Acid methyl ester (Methyl 17-methyl Octadecanoate Acid)Cas Number: 55124-97-5 Compound CID: 554141Formula: C20H40O2 Molecular Weight: 312.53IUPAC Name: methyl 17-methyloctadecanoateSMILES: CC(C)CCCCCCCCCCCCCCCC(=O)OCInChIKey: MASZVQKLIMRPFY-UHFFFAOYSA-NInChI: InChI=1S/C20H40O2/c1-19(2)17-15-13-11-9-7-5-4-6-8-10-12-14-16-18-20(21)22-3/h19H,4-18H2,1-3H3
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10-Undecynoic acid， methyl esterCas Number: 2777-66-4Formula: C12H20O2 Molecular Weight: 196.286SMILES: COC(=O)CCCCCCCCC#CInChIKey: TXFNJLOAXFOJGK-UHFFFAOYSA-NInChI: InChI=1S/C12H20O2/c1-3-4-5-6-7-8-9-10-11-12(13)14-2/h1H,4-11H2,2H3
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1-methylethane-1，2-diyl dipalmitateCas Number: 33587-20-1 Compound CID: 118091Formula: C35H68O4 Molecular Weight: 552.9IUPAC Name: 2-hexadecanoyloxypropyl hexadecanoateSMILES: CCCCCCCCCCCCCCCC(=O)OCC(C)OC(=O)CCCCCCCCCCCCCCCInChIKey: UWTZRBLIYNMYTC-UHFFFAOYSA-NInChI: InChI=1S/C35H68O4/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-34(36)38-32-33(3)39-35(37)31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h33H,4-32H2,1-3H3
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(Z)-(4-Ethoxy-4-oxo-2-buten-2-yl)boronic Acid Pinacol EsterIUPAC Name: ethyl (Z)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)but-2-enoateSMILES: B1(OC(C(O1)(C)C)(C)C)C(=CC(=O)OCC)CInChIKey: DFGFDUCQEBGHBQ-CMDGGOBGSA-NInChI: InChI=1S/C12H21BO4/c1-7-15-10(14)8-9(2)13-16-11(3,4)12(5,6)17-13/h8H,7H2,1-6H3/b9-8+
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Ethyl 12-bromododecanoateCas Number: 72338-48-8 Compound CID: 19002561Formula: C14H27BrO2 Molecular Weight: 307.27IUPAC Name: ethyl 12-bromododecanoateSMILES: CCOC(=O)CCCCCCCCCCCBrInChIKey: DYFVMVODIGRODW-UHFFFAOYSA-NInChI: InChI=1S/C14H27BrO2/c1-2-17-14(16)12-10-8-6-4-3-5-7-9-11-13-15/h2-13H2,1H3Synonyms: ethyl 12-bromododecanoate | Dodecanoic acid, 12-bromo-, ethyl ester | ethyl12-bromododecanoate
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6-O-Palmitoyl-L-ascorbic acidCas Number: 137-66-6 EC Number: 205-305-4Formula: C22H38O7 Molecular Weight: 414.53IUPAC Name: [(2S)-2-[(2R)-3,4-dihydroxy-5-oxo-2H-furan-2-yl]-2-hydroxyethyl] hexadecanoateSMILES: CCCCCCCCCCCCCCCC(=O)OCC(C1C(=C(C(=O)O1)O)O)OInChIKey: QAQJMLQRFWZOBN-LAUBAEHRSA-NInChI: InChI=1S/C22H38O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(24)28-16-17(23)21-19(25)20(26)22(27)29-21/h17,21,23,25-26H,2-16H2,1H3/t17-,21+/m0/s1
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mono-Methyl glutarateCas Number: 1501-27-5 EC Number: 216-116-1Formula: HOOC(CH2)3COOCH3 Molecular Weight: 146.14IUPAC Name: 5-methoxy-5-oxopentanoic acidSMILES: COC(=O)CCCC(=O)OInChIKey: IBMRTYCHDPMBFN-UHFFFAOYSA-NInChI: InChI=1S/C6H10O4/c1-10-6(9)4-2-3-5(7)8/h2-4H2,1H3,(H,7,8)Synonyms: Monomethyl glutarate Glutaric Acid Monomethyl Ester
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Methyl 5-HexenoateCas Number: 2396-80-7Formula: C7H12O2 Molecular Weight: 128.17IUPAC Name: methyl hex-5-enoateSMILES: COC(=O)CCCC=CInChIKey: ASKDFGVMJZMYEM-UHFFFAOYSA-NInChI: InChI=1S/C7H12O2/c1-3-4-5-6-7(8)9-2/h3H,1,4-6H2,2H3Synonyms: 5-Hexenoic acid methyl ester
