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: JXOFOOAZYUUFHE (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2126704

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C21H35NO4/c1-16(23)26-20(14-22-3-6-24-7-4-22)15-25-5-2-21-11-17-8-18(12-21)10-19(9-17)13-21/h17-20H,2-15H2,1H3
C21H35NO4365.50698400
5430969

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C21H35NO4/c1-16(23)26-20(14-22-3-6-24-7-4-22)15-25-5-2-21-11-17-8-18(12-21)10-19(9-17)13-21/h17-20H,2-15H2,1H3/t17?,18?,19?,20-,21?/m0/s1
C21H35NO4365.50692100
5430971

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C21H35NO4/c1-16(23)26-20(14-22-3-6-24-7-4-22)15-25-5-2-21-11-17-8-18(12-21)10-19(9-17)13-21/h17-20H,2-15H2,1H3/t17?,18?,19?,20-,21?/m1/s1
C21H35NO4365.50692100
5430970

Charge

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C21H35NO4/c1-16(23)26-20(14-22-3-6-24-7-4-22)15-25-5-2-21-11-17-8-18(12-21)10-19(9-17)13-21/h17-20H,2-15H2,1H3/p+1/t17?,18?,19?,20-,21?/m1/s1
C21H36NO4366.51431100
5430968

Charge

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C21H35NO4/c1-16(23)26-20(14-22-3-6-24-7-4-22)15-25-5-2-21-11-17-8-18(12-21)10-19(9-17)13-21/h17-20H,2-15H2,1H3/p+1/t17?,18?,19?,20-,21?/m0/s1
C21H36NO4366.51431100

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