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Lactones
Description:
Cyclic esters of hydroxy carboxylic acids, containing a 1-oxacycloalkan-2-one structure, or analogues having unsaturation or heteroatoms replacing one or more carbon atoms of the ring.
Ancestors:
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5-(Hydroxymethyl)dihydrofuran-2(3H)-oneCas Number: 10374-51-3Formula: C5H8O3 Molecular Weight: 116.11IUPAC Name: 5-(hydroxymethyl)oxolan-2-oneSMILES: C1CC(=O)OC1COInChIKey: NSISJFFVIMQBRN-UHFFFAOYSA-NInChI: InChI=1S/C5H8O3/c6-3-4-1-2-5(7)8-4/h4,6H,1-3H2Synonyms: 5-(hydroxymethyl)oxolan-2-one | 5-Hydroxymethyl-dihydro-furan-2-one -
4-Methyltetrahydro-2H-pyran-2-oneCas Number: 1121-84-2 Compound CID: 79142Formula: C6H10O2 Molecular Weight: 114.14IUPAC Name: 4-methyloxan-2-oneSMILES: CC1CCOC(=O)C1InChIKey: YHTLGFCVBKENTE-UHFFFAOYSA-NInChI: InChI=1S/C6H10O2/c1-5-2-3-8-6(7)4-5/h5H,2-4H2,1H3
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4-(Hydroxymethyl)dihydrofuran-2(3H)-oneCas Number: 36679-81-9 Compound CID: 9964081Formula: C5H8O3 Molecular Weight: 116.11IUPAC Name: 4-(hydroxymethyl)oxolan-2-oneSMILES: C1C(COC1=O)COInChIKey: PVQRPRXBBGDUMX-UHFFFAOYSA-NInChI: InChI=1S/C5H8O3/c6-2-4-1-5(7)8-3-4/h4,6H,1-3H2
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3-Hydroxytetrahydro-2H-pyran-2-oneCas Number: 5058-01-5 Compound CID: 98452Formula: C5H8O3 Molecular Weight: 116.11IUPAC Name: 3-hydroxyoxan-2-oneSMILES: C1CC(C(=O)OC1)OInChIKey: FHSAZOGISLHXPK-UHFFFAOYSA-NInChI: InChI=1S/C5H8O3/c6-4-2-1-3-8-5(4)7/h4,6H,1-3H2
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2-oxo-1-oxaspiro[4.4]nonane-4-carboxylic acidCas Number: 18363-10-5 Compound CID: 2772064Formula: C9H12O4 Molecular Weight: 184.19IUPAC Name: 2-oxo-1-oxaspiro[4.4]nonane-4-carboxylic acidSMILES: C1CCC2(C1)C(CC(=O)O2)C(=O)OInChIKey: RHSJEQPXBBAWME-UHFFFAOYSA-NInChI: InChI=1S/C9H12O4/c10-7-5-6(8(11)12)9(13-7)3-1-2-4-9/h6H,1-5H2,(H,11,12)
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2-oxo-1-oxaspiro[4.5]decane-4-carboxylic acidCas Number: 2819-56-9 Compound CID: 95242Formula: C10H14O4 Molecular Weight: 198.218IUPAC Name: 2-oxo-1-oxaspiro[4.5]decane-4-carboxylic acidSMILES: C1CCC2(CC1)C(CC(=O)O2)C(=O)OInChIKey: ZTXZIBLPLHQZAQ-UHFFFAOYSA-NInChI: InChI=1S/C10H14O4/c11-8-6-7(9(12)13)10(14-8)4-2-1-3-5-10/h7H,1-6H2,(H,12,13)
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(±)-Corey lactone diolCas Number: 54423-47-1Formula: C8H12O4 Molecular Weight: 172.18IUPAC Name: (3aR,4S,5R,6aS)-5-hydroxy-4-(hydroxymethyl)-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-2-oneSMILES: C1C(C(C2C1OC(=O)C2)CO)OInChIKey: VYTZWRCSPHQSFX-GBNDHIKLSA-NInChI: InChI=1S/C8H12O4/c9-3-5-4-1-8(11)12-7(4)2-6(5)10/h4-7,9-10H,1-3H2/t4-,5-,6-,7+/m1/s1Synonyms: rel-Corey lactone diol | rel-(3aR,4S,5R,6aS)-Hexahydro-5-hydroxy-4-(hydroxymethyl)-2H-cyclopenta[b]furan-2-one
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tert-butyl N-[(3S)-6-oxotetrahydropyran-3-yl]carbamateCas Number: 125982-23-2 Compound CID: 14409468Formula: C10H17NO4 Molecular Weight: 215.25IUPAC Name: tert-butyl N-[(3S)-6-oxooxan-3-yl]carbamateSMILES: CC(C)(C)OC(=O)NC1CCC(=O)OC1InChIKey: NIZFUEFAOHKWFS-ZETCQYMHSA-NInChI: InChI=1S/C10H17NO4/c1-10(2,3)15-9(13)11-7-4-5-8(12)14-6-7/h7H,4-6H2,1-3H3,(H,11,13)/t7-/m0/s1
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5-oxaspiro[2.4]heptan-6-oneCas Number: 33867-36-6 Compound CID: 10219402Formula: C6H8O2 Molecular Weight: 112.13SMILES: C1CC12CC(=O)OC2InChIKey: VDDTXNQOEDQFSZ-UHFFFAOYSA-NInChI: InChI=1S/C6H8O2/c7-5-3-6(1-2-6)4-8-5/h1-4H2
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C75Cas Number: 218137-86-1Formula: C14H22O4 Molecular Weight: 254.32IUPAC Name: 4-methylidene-2-octyl-5-oxooxolane-3-carboxylic acidSMILES: CCCCCCCCC1C(C(=C)C(=O)O1)C(=O)OInChIKey: VCWLZDVWHQVAJU-UHFFFAOYSA-NInChI: InChI=1S/C14H22O4/c1-3-4-5-6-7-8-9-11-12(13(15)16)10(2)14(17)18-11/h11-12H,2-9H2,1H3,(H,15,16)Synonyms: EX-A3806 | BDBM50525849 | MS-23584 | 4-methylidene-2-octyl-5-oxotetrahydrofuran-3-carboxylic acid | DTXSID401189534 |...
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β-PropiolactoneFormula: C3H4O2 Molecular Weight: 72.06IUPAC Name: oxetan-2-oneSMILES: C1COC1=OInChIKey: VEZXCJBBBCKRPI-UHFFFAOYSA-NInChI: InChI=1S/C3H4O2/c4-3-1-2-5-3/h1-2H2Synonyms: beta-propiolactone|2-Oxetanone|Propiolactone|57-57-8|Oxetan-2-one|Betaprone|Propanolide|3-Propanolide|1,3-Propiolacto...
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ethyl 3,4,5,6-tetrahydro-2-oxo-2h-pyran-3-carboxylateCas Number: 150013-91-5 Compound CID: 10261551Formula: C8H12O4 Molecular Weight: 172.18IUPAC Name: ethyl 2-oxooxane-3-carboxylateSMILES: CCOC(=O)C1CCCOC1=OInChIKey: XVBKSIUXFJGFGK-UHFFFAOYSA-NInChI: InChI=1S/C8H12O4/c1-2-11-7(9)6-4-3-5-12-8(6)10/h6H,2-5H2,1H3Synonyms: 150013-91-5 | ethyl 3,4,5,6-tetrahydro-2-oxo-2H-pyran-3-carboxylate | Ethyl 2-oxooxane-3-carboxylate | Ethyl 2-oxotet...
