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: LWBUFIVLKKMBJZ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
10882883

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C25H35NO4/c1-26(21-7-5-4-6-8-21)17-22(27)18-30-25(19-9-13-23(28-2)14-10-19)20-11-15-24(29-3)16-12-20/h9-16,21-22,25,27H,4-8,17-18H2,1-3H3
C25H35NO4413.549711800
6461449

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C25H35NO4/c1-26(21-7-5-4-6-8-21)17-22(27)18-30-25(19-9-13-23(28-2)14-10-19)20-11-15-24(29-3)16-12-20/h9-16,21-22,25,27H,4-8,17-18H2,1-3H3/t22-/m0/s1
C25H35NO4413.54973200
6461453

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C25H35NO4/c1-26(21-7-5-4-6-8-21)17-22(27)18-30-25(19-9-13-23(28-2)14-10-19)20-11-15-24(29-3)16-12-20/h9-16,21-22,25,27H,4-8,17-18H2,1-3H3/t22-/m1/s1
C25H35NO4413.54972100
6461448

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C25H35NO4/c1-26(21-7-5-4-6-8-21)17-22(27)18-30-25(19-9-13-23(28-2)14-10-19)20-11-15-24(29-3)16-12-20/h9-16,21-22,25,27H,4-8,17-18H2,1-3H3/p+1/t22-/m0/s1
C25H36NO4414.55711100
6461452

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C25H35NO4/c1-26(21-7-5-4-6-8-21)17-22(27)18-30-25(19-9-13-23(28-2)14-10-19)20-11-15-24(29-3)16-12-20/h9-16,21-22,25,27H,4-8,17-18H2,1-3H3/p+1/t22-/m1/s1
C25H36NO4414.55711100

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