Matches any text strings used to describe a molecule.
Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
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Found 33 results

Search term: FOLRUCXBTYDAQK (Found by InChIKey (skeleton match))
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
5293178

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C13H16O6/c14-9-10(15)12(16)18-8-6-17-13(19-11(8)9)7-4-2-1-3-5-7/h1-5,8-16H,6H2/t8-,9-,10-,11-,12?,13?/m1/s1
C13H16O6268.26254443736
90445

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C13H16O6/c14-9-10(15)12(16)18-8-6-17-13(19-11(8)9)7-4-2-1-3-5-7/h1-5,8-16H,6H2
C13H16O6268.2625161000
2029201

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C13H16O6/c14-9-10(15)12(16)18-8-6-17-13(19-11(8)9)7-4-2-1-3-5-7/h1-5,8-16H,6H2/t8-,9-,10-,11+,12+,13?/m1/s1
C13H16O6268.2625411800
9087769

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C13H16O6/c14-9-10(15)12(16)18-8-6-17-13(19-11(8)9)7-4-2-1-3-5-7/h1-5,8-16H,6H2/t8-,9-,10-,11-,12+,13?/m1/s1
C13H16O6268.262510800
7971127

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C13H16O6/c14-9-10(15)12(16)18-8-6-17-13(19-11(8)9)7-4-2-1-3-5-7/h1-5,8-16H,6H2/t8-,9-,10-,11-,12?,13-/m1/s1
C13H16O6268.26257800
28599690

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C13H16O6/c14-9-10(15)12(16)18-8-6-17-13(19-11(8)9)7-4-2-1-3-5-7/h1-5,8-16H,6H2/t8-,9-,10-,11+,12?,13?/m1/s1
C13H16O6268.26254200
8374747

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C13H16O6/c14-9-10(15)12(16)18-8-6-17-13(19-11(8)9)7-4-2-1-3-5-7/h1-5,8-16H,6H2/t8-,9-,10+,11-,12?,13-/m1/s1
C13H16O6268.26253200
22900291

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C13H16O6/c14-9-10(15)12(16)18-8-6-17-13(19-11(8)9)7-4-2-1-3-5-7/h1-5,8-16H,6H2/t8-,9-,10-,11?,12?,13-/m1/s1
C13H16O6268.26253300
8013976

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C13H16O6/c14-9-10(15)12(16)18-8-6-17-13(19-11(8)9)7-4-2-1-3-5-7/h1-5,8-16H,6H2/t8-,9-,10-,11+,12?,13+/m1/s1
C13H16O6268.26253200
8057509

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C13H16O6/c14-9-10(15)12(16)18-8-6-17-13(19-11(8)9)7-4-2-1-3-5-7/h1-5,8-16H,6H2/t8?,9-,10-,11?,12-,13-/m0/s1
C13H16O6268.26252100
8079132

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C13H16O6/c14-9-10(15)12(16)18-8-6-17-13(19-11(8)9)7-4-2-1-3-5-7/h1-5,8-16H,6H2/t8?,9-,10+,11?,12-,13-/m0/s1
C13H16O6268.26252100
8374746

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C13H16O6/c14-9-10(15)12(16)18-8-6-17-13(19-11(8)9)7-4-2-1-3-5-7/h1-5,8-16H,6H2/t8?,9-,10-,11?,12+,13-/m0/s1
C13H16O6268.26252100
5410107

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C13H16O6/c14-9-10(15)12(16)18-8-6-17-13(19-11(8)9)7-4-2-1-3-5-7/h1-5,8-16H,6H2/t8-,9-,10-,11+,12+,13-/m1/s1
C13H16O6268.26252100
5410108

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C13H16O6/c14-9-10(15)12(16)18-8-6-17-13(19-11(8)9)7-4-2-1-3-5-7/h1-5,8-16H,6H2/t8-,9-,10-,11+,12+,13+/m1/s1
C13H16O6268.26252100
23976094

2 of 6 defined stereocentres - 2/6 defined
InChI=1/C13H16O6/c14-9-10(15)12(16)18-8-6-17-13(19-11(8)9)7-4-2-1-3-5-7/h1-5,8-16H,6H2/t8?,9-,10?,11-,12?,13?/m1/s1
C13H16O6268.26252100
26570281

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C13H16O6/c14-9-10(15)12(16)18-8-6-17-13(19-11(8)9)7-4-2-1-3-5-7/h1-5,8-16H,6H2/t8-,9-,10-,11-,12u,13-/m1/s1
C13H16O6268.26252300
9645988

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C13H16O6/c14-9-10(15)12(16)18-8-6-17-13(19-11(8)9)7-4-2-1-3-5-7/h1-5,8-16H,6H2/t8-,9-,10-,11-,12?,13-/m0/s1
C13H16O6268.26252100
8396541

4 of 6 defined stereocentres - 4/6 defined

Non-standard isotope
InChI=1/C13H16O6/c14-9-10(15)12(16)18-8-6-17-13(19-11(8)9)7-4-2-1-3-5-7/h1-5,8-16H,6H2/t8-,9-,10-,11-,12?,13?/m1/s1/i13D
C13H15DO6269.26872200
7992581

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C13H16O6/c14-9-10(15)12(16)18-8-6-17-13(19-11(8)9)7-4-2-1-3-5-7/h1-5,8-16H,6H2/t8?,9-,10-,11?,12-,13-/m1/s1
C13H16O6268.26252100
8013975

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C13H16O6/c14-9-10(15)12(16)18-8-6-17-13(19-11(8)9)7-4-2-1-3-5-7/h1-5,8-16H,6H2/t8?,9-,10-,11?,12+,13-/m1/s1
C13H16O6268.26252100
12

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