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 3 results

Search term: QDEAHQHAMWJGCT (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3501654

Double-bond stereo

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C33H41N3O7/c37-23-33(17-9-10-18-33)36-29(38)20-26-15-7-8-16-28(35-32(41)43-21-25-13-5-2-6-14-25)31(40)42-22-27(34-30(26)39)19-24-11-3-1-4-12-24/h1-8,11-14,26-28,37H,9-10,15-23H2,(H,34,39)(H,35,41)(H,36,38)
C33H41N3O7591.6945399999982100
5040151

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C33H41N3O7/c37-23-33(17-9-10-18-33)36-29(38)20-26-15-7-8-16-28(35-32(41)43-21-25-13-5-2-6-14-25)31(40)42-22-27(34-30(26)39)19-24-11-3-1-4-12-24/h1-8,11-14,26-28,37H,9-10,15-23H2,(H,34,39)(H,35,41)(H,36,38)/t26-,27+,28-/m1/s1
C33H41N3O7591.69452100
5040655

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C33H41N3O7/c37-23-33(17-9-10-18-33)36-29(38)20-26-15-7-8-16-28(35-32(41)43-21-25-13-5-2-6-14-25)31(40)42-22-27(34-30(26)39)19-24-11-3-1-4-12-24/h1-8,11-14,26-28,37H,9-10,15-23H2,(H,34,39)(H,35,41)(H,36,38)/t26-,27-,28-/m1/s1
C33H41N3O7591.69452100

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