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 21 results

Search term: XYGMEFJSKQEBTO (Found by InChIKey (skeleton match))
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
12762

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H29ClO3/c1-12(23)25-18-7-6-14-13-4-5-16-19(22)17(24)9-11-20(16,2)15(13)8-10-21(14,18)3/h13-15,18H,4-11H2,1-3H3/t13-,14-,15-,18-,20+,21-/m0/s1
C21H29ClO3364.9062661362219
470030

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C21H29ClO3/c1-12(23)25-18-7-6-14-13-4-5-16-19(22)17(24)9-11-20(16,2)15(13)8-10-21(14,18)3/h13-15,18H,4-11H2,1-3H3
C21H29ClO3364.9062123200
17460096

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C21H29ClO3/c1-12(23)25-18-7-6-14-13-4-5-16-19(22)17(24)9-11-20(16,2)15(13)8-10-21(14,18)3/h13-15,18H,4-11H2,1-3H3/t13-,14?,15?,18-,20+,21-/m0/s1
C21H29ClO3364.906210500
17460718

2 of 6 defined stereocentres - 2/6 defined
InChI=1/C21H29ClO3/c1-12(23)25-18-7-6-14-13-4-5-16-19(22)17(24)9-11-20(16,2)15(13)8-10-21(14,18)3/h13-15,18H,4-11H2,1-3H3/t13?,14?,15?,18?,20-,21+/m1/s1
C21H29ClO3364.90624100
5417181

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H29ClO3/c1-12(23)25-18-7-6-14-13-4-5-16-19(22)17(24)9-11-20(16,2)15(13)8-10-21(14,18)3/h13-15,18H,4-11H2,1-3H3/t13-,14+,15-,18+,20-,21+/m1/s1
C21H29ClO3364.90622100
5417182

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H29ClO3/c1-12(23)25-18-7-6-14-13-4-5-16-19(22)17(24)9-11-20(16,2)15(13)8-10-21(14,18)3/h13-15,18H,4-11H2,1-3H3/t13-,14-,15-,18+,20-,21+/m1/s1
C21H29ClO3364.90622100
5973619

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H29ClO3/c1-12(23)25-18-7-6-14-13-4-5-16-19(22)17(24)9-11-20(16,2)15(13)8-10-21(14,18)3/h13-15,18H,4-11H2,1-3H3/t13-,14-,15+,18-,20+,21-/m0/s1
C21H29ClO3364.90622100
5973620

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H29ClO3/c1-12(23)25-18-7-6-14-13-4-5-16-19(22)17(24)9-11-20(16,2)15(13)8-10-21(14,18)3/h13-15,18H,4-11H2,1-3H3/t13-,14+,15+,18-,20+,21-/m0/s1
C21H29ClO3364.90622100
9901036

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C21H29ClO3/c1-12(23)25-18-7-6-14-13-4-5-16-19(22)17(24)9-11-20(16,2)15(13)8-10-21(14,18)3/h13-15,18H,4-11H2,1-3H3/t13?,14-,15-,18-,20+,21-/m0/s1
C21H29ClO3364.90622100
10043985

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H29ClO3/c1-12(23)25-18-7-6-14-13-4-5-16-19(22)17(24)9-11-20(16,2)15(13)8-10-21(14,18)3/h13-15,18H,4-11H2,1-3H3/t13-,14+,15-,18-,20+,21-/m0/s1
C21H29ClO3364.90622100
10085700

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H29ClO3/c1-12(23)25-18-7-6-14-13-4-5-16-19(22)17(24)9-11-20(16,2)15(13)8-10-21(14,18)3/h13-15,18H,4-11H2,1-3H3/t13-,14+,15-,18-,20-,21+/m1/s1
C21H29ClO3364.90622100
10085703

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H29ClO3/c1-12(23)25-18-7-6-14-13-4-5-16-19(22)17(24)9-11-20(16,2)15(13)8-10-21(14,18)3/h13-15,18H,4-11H2,1-3H3/t13-,14-,15-,18-,20-,21+/m1/s1
C21H29ClO3364.90622100
58817685

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C21H29ClO3/c1-12(23)25-18-7-6-14-13-4-5-16-19(22)17(24)9-11-20(16,2)15(13)8-10-21(14,18)3/h13-15,18H,4-11H2,1-3H3/t13-,14-,15-,18-,20?,21?/m0/s1
C21H29ClO3364.90621200
62388081

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C21H29ClO3/c1-12(23)25-18-7-6-14-13-4-5-16-19(22)17(24)9-11-20(16,2)15(13)8-10-21(14,18)3/h13-15,18H,4-11H2,1-3H3/t13-,14+,15-,18+,20+,21-/m1/s1
C21H29ClO3364.90621100
62527782

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C21H29ClO3/c1-12(23)25-18-7-6-14-13-4-5-16-19(22)17(24)9-11-20(16,2)15(13)8-10-21(14,18)3/h13-15,18H,4-11H2,1-3H3/t13-,14-,15-,18-,20-,21+/m0/s1
C21H29ClO3364.90621100
110092427

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C21H29ClO3/c1-12(23)25-18-7-6-14-13-4-5-16-19(22)17(24)9-11-20(16,2)15(13)8-10-21(14,18)3/h13-15,18H,4-11H2,1-3H3/t13-,14?,15?,18-,20+,21-/m1/s1
C21H29ClO3364.90621100
110092737

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H29ClO3/c1-12(23)25-18-7-6-14-13-4-5-16-19(22)17(24)9-11-20(16,2)15(13)8-10-21(14,18)3/h13-15,18H,4-11H2,1-3H3/t13-,14-,15-,18-,20+,21-/m1/s1
C21H29ClO3364.90621100
111310329

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H29ClO3/c1-12(23)25-18-7-6-14-13-4-5-16-19(22)17(24)9-11-20(16,2)15(13)8-10-21(14,18)3/h13-15,18H,4-11H2,1-3H3/t13-,14+,15+,18-,20+,21-/m1/s1
C21H29ClO3364.90621100
114547254

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H29ClO3/c1-12(23)25-18-7-6-14-13-4-5-16-19(22)17(24)9-11-20(16,2)15(13)8-10-21(14,18)3/h13-15,18H,4-11H2,1-3H3/t13-,14-,15-,18-,20+,21+/m0/s1
C21H29ClO3364.90621100
114816559

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C21H29ClO3/c1-12(23)25-18-7-6-14-13-4-5-16-19(22)17(24)9-11-20(16,2)15(13)8-10-21(14,18)3/h13-15,18H,4-11H2,1-3H3/t13-,14-,15+,18-,20-,21-/m0/s1
C21H29ClO3364.90621100
12

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