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 9 results

Search term: HEHNRBQRNGNKME (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2240015

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C26H29N3O/c1-5-16-12-19-15(2)14-25(3,4)29-22(19)20(13-16)26(24(29)30)23-18(10-11-27-26)17-8-6-7-9-21(17)28-23/h6-9,12-13,15,27-28H,5,10-11,14H2,1-4H3
C26H29N3O399.52796251700
1052465

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C26H29N3O/c1-5-16-12-19-15(2)14-25(3,4)29-22(19)20(13-16)26(24(29)30)23-18(10-11-27-26)17-8-6-7-9-21(17)28-23/h6-9,12-13,15,27-28H,5,10-11,14H2,1-4H3/t15-,26+/m1/s1
C26H29N3O399.5282100
1052466

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C26H29N3O/c1-5-16-12-19-15(2)14-25(3,4)29-22(19)20(13-16)26(24(29)30)23-18(10-11-27-26)17-8-6-7-9-21(17)28-23/h6-9,12-13,15,27-28H,5,10-11,14H2,1-4H3/t15-,26-/m0/s1
C26H29N3O399.5282100
1052467

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C26H29N3O/c1-5-16-12-19-15(2)14-25(3,4)29-22(19)20(13-16)26(24(29)30)23-18(10-11-27-26)17-8-6-7-9-21(17)28-23/h6-9,12-13,15,27-28H,5,10-11,14H2,1-4H3/t15-,26-/m1/s1
C26H29N3O399.5282100
1052468

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C26H29N3O/c1-5-16-12-19-15(2)14-25(3,4)29-22(19)20(13-16)26(24(29)30)23-18(10-11-27-26)17-8-6-7-9-21(17)28-23/h6-9,12-13,15,27-28H,5,10-11,14H2,1-4H3/t15-,26+/m0/s1
C26H29N3O399.5282100
5442664

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C26H29N3O/c1-5-16-12-19-15(2)14-25(3,4)29-22(19)20(13-16)26(24(29)30)23-18(10-11-27-26)17-8-6-7-9-21(17)28-23/h6-9,12-13,15,27-28H,5,10-11,14H2,1-4H3/p+1/t15-,26-/m1/s1
C26H30N3O400.53541100
5442665

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C26H29N3O/c1-5-16-12-19-15(2)14-25(3,4)29-22(19)20(13-16)26(24(29)30)23-18(10-11-27-26)17-8-6-7-9-21(17)28-23/h6-9,12-13,15,27-28H,5,10-11,14H2,1-4H3/p+1/t15-,26+/m1/s1
C26H30N3O400.53541100
5442666

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C26H29N3O/c1-5-16-12-19-15(2)14-25(3,4)29-22(19)20(13-16)26(24(29)30)23-18(10-11-27-26)17-8-6-7-9-21(17)28-23/h6-9,12-13,15,27-28H,5,10-11,14H2,1-4H3/p+1/t15-,26+/m0/s1
C26H30N3O400.53541100
5442667

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C26H29N3O/c1-5-16-12-19-15(2)14-25(3,4)29-22(19)20(13-16)26(24(29)30)23-18(10-11-27-26)17-8-6-7-9-21(17)28-23/h6-9,12-13,15,27-28H,5,10-11,14H2,1-4H3/p+1/t15-,26-/m0/s1
C26H30N3O400.53541100

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