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 5 results

Search term: FHVSNLJUXOHYKC (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2967531

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C29H33N3O5/c1-5-18-14-19-25(34)23(28-30-21-11-7-8-12-22(21)31(28)4)27(29(35)36-6-2)37-26(19)20(24(18)33)16-32-13-9-10-17(3)15-32/h7-8,11-12,14,17,33H,5-6,9-10,13,15-16H2,1-4H3
C29H33N3O5503.58942181700
1038747

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C29H33N3O5/c1-5-18-14-19-25(34)23(28-30-21-11-7-8-12-22(21)31(28)4)27(29(35)36-6-2)37-26(19)20(24(18)33)16-32-13-9-10-17(3)15-32/h7-8,11-12,14,17,33H,5-6,9-10,13,15-16H2,1-4H3/t17-/m1/s1
C29H33N3O5503.58942100
1038748

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C29H33N3O5/c1-5-18-14-19-25(34)23(28-30-21-11-7-8-12-22(21)31(28)4)27(29(35)36-6-2)37-26(19)20(24(18)33)16-32-13-9-10-17(3)15-32/h7-8,11-12,14,17,33H,5-6,9-10,13,15-16H2,1-4H3/t17-/m0/s1
C29H33N3O5503.58942100
7818286

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C29H33N3O5/c1-5-18-14-19-25(34)23(28-30-21-11-7-8-12-22(21)31(28)4)27(29(35)36-6-2)37-26(19)20(24(18)33)16-32-13-9-10-17(3)15-32/h7-8,11-12,14,17,33H,5-6,9-10,13,15-16H2,1-4H3/p+1/t17-/m0/s1
C29H34N3O5504.59681100
7818287

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C29H33N3O5/c1-5-18-14-19-25(34)23(28-30-21-11-7-8-12-22(21)31(28)4)27(29(35)36-6-2)37-26(19)20(24(18)33)16-32-13-9-10-17(3)15-32/h7-8,11-12,14,17,33H,5-6,9-10,13,15-16H2,1-4H3/p+1/t17-/m1/s1
C29H34N3O5504.59681100

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