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
Additional Filters

Found 19 results

Search term: JKTJXQQVMKZKQA (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
9068342

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C13H23NO9/c1-6(16)14-9-7(17)4-13(22-3,12(20)21-2)23-11(9)10(19)8(18)5-15/h7-11,15,17-19H,4-5H2,1-3H3,(H,14,16)/t7-,8+,9+,10+,11+,13-/m0/s1
C13H23NO9337.32312900
3650770

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C13H23NO9/c1-6(16)14-9-7(17)4-13(22-3,12(20)21-2)23-11(9)10(19)8(18)5-15/h7-11,15,17-19H,4-5H2,1-3H3,(H,14,16)
C13H23NO9337.323025200
23234485

2 of 6 defined stereocentres - 2/6 defined
InChI=1/C13H23NO9/c1-6(16)14-9-7(17)4-13(22-3,12(20)21-2)23-11(9)10(19)8(18)5-15/h7-11,15,17-19H,4-5H2,1-3H3,(H,14,16)/t7?,8-,9?,10-,11?,13?/m1/s1
C13H23NO9337.3233100
9210271

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C13H23NO9/c1-6(16)14-9-7(17)4-13(22-3,12(20)21-2)23-11(9)10(19)8(18)5-15/h7-11,15,17-19H,4-5H2,1-3H3,(H,14,16)/t7-,8+,9+,10+,11+,13+/m0/s1
C13H23NO9337.3233100
21473593

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C13H23NO9/c1-6(16)14-9-7(17)4-13(22-3,12(20)21-2)23-11(9)10(19)8(18)5-15/h7-11,15,17-19H,4-5H2,1-3H3,(H,14,16)/t7-,8+,9-,10+,11?,13-/m0/s1
C13H23NO9337.3232100
4643105

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C13H23NO9/c1-6(16)14-9-7(17)4-13(22-3,12(20)21-2)23-11(9)10(19)8(18)5-15/h7-11,15,17-19H,4-5H2,1-3H3,(H,14,16)/t7-,8+,9+,10-,11?,13+/m0/s1
C13H23NO9337.3232200
32696911

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C13H23NO9/c1-6(16)14-9-7(17)4-13(22-3,12(20)21-2)23-11(9)10(19)8(18)5-15/h7-11,15,17-19H,4-5H2,1-3H3,(H,14,16)/t7-,8+,9+,10+,11+,13?/m0/s1
C13H23NO9337.3232100
64852235

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C13H23NO9/c1-6(16)14-9-7(17)4-13(22-3,12(20)21-2)23-11(9)10(19)8(18)5-15/h7-11,15,17-19H,4-5H2,1-3H3,(H,14,16)/t7-,8+,9+,10+,11?,13+/m0/s1
C13H23NO9337.3231200
68025958

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C13H23NO9/c1-6(16)14-9-7(17)4-13(22-3,12(20)21-2)23-11(9)10(19)8(18)5-15/h7-11,15,17-19H,4-5H2,1-3H3,(H,14,16)/t7-,8-,9?,10+,11+,13-/m0/s1
C13H23NO9337.3231100
74091862

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C13H23NO9/c1-6(16)14-9-7(17)4-13(22-3,12(20)21-2)23-11(9)10(19)8(18)5-15/h7-11,15,17-19H,4-5H2,1-3H3,(H,14,16)/t7-,8+,9+,10+,11?,13-/m0/s1
C13H23NO9337.3231100
78428201

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C13H23NO9/c1-6(16)14-9-7(17)4-13(22-3,12(20)21-2)23-11(9)10(19)8(18)5-15/h7-11,15,17-19H,4-5H2,1-3H3,(H,14,16)/t7-,8+,9-,10-,11?,13+/m1/s1
C13H23NO9337.3231100
107441342

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C13H23NO9/c1-6(16)14-9-7(17)4-13(22-3,12(20)21-2)23-11(9)10(19)8(18)5-15/h7-11,15,17-19H,4-5H2,1-3H3,(H,14,16)/t7-,8+,9?,10+,11+,13-/m0/s1
C13H23NO9337.3231400
107450557

6 of 6 defined stereocentres - 6/6 defined

Non-standard isotope
InChI=1/C13H23NO9/c1-6(16)14-9-7(17)4-13(22-3,12(20)21-2)23-11(9)10(19)8(18)5-15/h7-11,15,17-19H,4-5H2,1-3H3,(H,14,16)/t7-,8+,9+,10+,11+,13-/m0/s1/i1D3,6+1
C1213CH20D3NO9341.33421100
111308910

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C13H23NO9/c1-6(16)14-9-7(17)4-13(22-3,12(20)21-2)23-11(9)10(19)8(18)5-15/h7-11,15,17-19H,4-5H2,1-3H3,(H,14,16)/t7-,8-,9-,10-,11?,13-/m0/s1
C13H23NO9337.3231100
111309182

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C13H23NO9/c1-6(16)14-9-7(17)4-13(22-3,12(20)21-2)23-11(9)10(19)8(18)5-15/h7-11,15,17-19H,4-5H2,1-3H3,(H,14,16)/t7-,8-,9-,10-,11?,13+/m0/s1
C13H23NO9337.3231100
115041269

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C13H23NO9/c1-6(16)14-9-7(17)4-13(22-3,12(20)21-2)23-11(9)10(19)8(18)5-15/h7-11,15,17-19H,4-5H2,1-3H3,(H,14,16)/t7-,8-,9-,10-,11?,13+/m1/s1
C13H23NO9337.3231100
28638408

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C13H23NO9/c1-6(16)14-9-7(17)4-13(22-3,12(20)21-2)23-11(9)10(19)8(18)5-15/h7-11,15,17-19H,4-5H2,1-3H3,(H,14,16)/t7-,8-,9-,10-,11?,13-/m1/s1
C13H23NO9337.3231100
23199668

2 of 6 defined stereocentres - 2/6 defined
InChI=1/C13H23NO9/c1-6(16)14-9-7(17)4-13(22-3,12(20)21-2)23-11(9)10(19)8(18)5-15/h7-11,15,17-19H,4-5H2,1-3H3,(H,14,16)/t7?,8-,9?,10+,11?,13?/m1/s1
C13H23NO9337.3231100

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