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 16 results

Search term: XGYIMTFOTBMPFP (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
388325

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C10H13N5O3/c1-4-6(16)7(17)10(18-4)15-3-14-5-8(11)12-2-13-9(5)15/h2-4,6-7,10,16-17H,1H3,(H2,11,12,13)/t4-,6-,7-,10-/m1/s1
C10H13N5O3251.24197914526763
1072306

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C10H13N5O3/c1-4-6(16)7(17)10(18-4)15-3-14-5-8(11)12-2-13-9(5)15/h2-4,6-7,10,16-17H,1H3,(H2,11,12,13)/t4-,6+,7-,10-/m1/s1
C10H13N5O3251.24195500
4911253

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C10H13N5O3/c1-4-6(16)7(17)10(18-4)15-3-14-5-8(11)12-2-13-9(5)15/h2-4,6-7,10,16-17H,1H3,(H2,11,12,13)/t4-,6-,7-,10?/m1/s1
C10H13N5O3251.24193300
395673

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C10H13N5O3/c1-4-6(16)7(17)10(18-4)15-3-14-5-8(11)12-2-13-9(5)15/h2-4,6-7,10,16-17H,1H3,(H2,11,12,13)/t4-,6+,7+,10+/m0/s1
C10H13N5O3251.24193500
589469

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C10H13N5O3/c1-4-6(16)7(17)10(18-4)15-3-14-5-8(11)12-2-13-9(5)15/h2-4,6-7,10,16-17H,1H3,(H2,11,12,13)/t4-,6+,7+,10+/m1/s1
C10H13N5O3251.24192100
5302893

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C10H13N5O3/c1-4-6(16)7(17)10(18-4)15-3-14-5-8(11)12-2-13-9(5)15/h2-4,6-7,10,16-17H,1H3,(H2,11,12,13)/t4-,6-,7-,10-/m0/s1
C10H13N5O3251.241922100
35518784

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C10H13N5O3/c1-4-6(16)7(17)10(18-4)15-3-14-5-8(11)12-2-13-9(5)15/h2-4,6-7,10,16-17H,1H3,(H2,11,12,13)/t4-,6+,7?,10-/m1/s1
C10H13N5O3251.24192300
75584719

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C10H13N5O3/c1-4-6(16)7(17)10(18-4)15-3-14-5-8(11)12-2-13-9(5)15/h2-4,6-7,10,16-17H,1H3,(H2,11,12,13)/t4?,6-,7-,10?/m1/s1
C10H13N5O3251.24191100
78272970

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C10H13N5O3/c1-4-6(16)7(17)10(18-4)15-3-14-5-8(11)12-2-13-9(5)15/h2-4,6-7,10,16-17H,1H3,(H2,11,12,13)/t4-,6?,7?,10-/m0/s1
C10H13N5O3251.24191100
114394470

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C10H13N5O3/c1-4-6(16)7(17)10(18-4)15-3-14-5-8(11)12-2-13-9(5)15/h2-4,6-7,10,16-17H,1H3,(H2,11,12,13)/t4-,6-,7-,10-/m1/s1/i1T3
C10H10T3N5O3257.26621100
117035642

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C10H13N5O3/c1-4-6(16)7(17)10(18-4)15-3-14-5-8(11)12-2-13-9(5)15/h2-4,6-7,10,16-17H,1H3,(H2,11,12,13)/t4-,6-,7-,10+/m1/s1
C10H13N5O3251.24191100
9182971

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C10H13N5O3/c1-4-6(16)7(17)10(18-4)15-3-14-5-8(11)12-2-13-9(5)15/h2-4,6-7,10,16-17H,1H3,(H2,11,12,13)/t4-,6-,7-,10-/m1/s1/i1+1
C913CH13N5O3252.23461200
20556896

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C10H13N5O3/c1-4-6(16)7(17)10(18-4)15-3-14-5-8(11)12-2-13-9(5)15/h2-4,6-7,10,16-17H,1H3,(H2,11,12,13)/t4-,6+,7-,10?/m1/s1
C10H13N5O3251.24191100
29789237

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C10H13N5O3/c1-4-6(16)7(17)10(18-4)15-3-14-5-8(11)12-2-13-9(5)15/h2-4,6-7,10,16-17H,1H3,(H2,11,12,13)/t4-,6?,7?,10-/m1/s1
C10H13N5O3251.24191100

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