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
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Found 4 results

Search term: DEKOIOTXPOCTSP (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
129035566

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C22H28NO4P/c23-22(15-27-28(24,25)26)11-10-21(14-22)20-9-8-18-12-17(6-7-19(18)13-20)16-4-2-1-3-5-16/h1-5,8-9,13,17,21H,6-7,10-12,14-15,23H2,(H2,24,25,26)/t17?,21-,22-/m0/s1
C22H28NO4P401.43581100
129035567

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C22H28NO4P/c23-22(15-27-28(24,25)26)11-10-21(14-22)20-9-8-18-12-17(6-7-19(18)13-20)16-4-2-1-3-5-16/h1-5,8-9,13,17,21H,6-7,10-12,14-15,23H2,(H2,24,25,26)/t17?,21-,22+/m0/s1
C22H28NO4P401.43581100
129147015

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C22H28NO4P/c23-22(15-27-28(24,25)26)11-10-21(14-22)20-9-8-18-12-17(6-7-19(18)13-20)16-4-2-1-3-5-16/h1-5,8-9,13,17,21H,6-7,10-12,14-15,23H2,(H2,24,25,26)/t17-,21-,22+/m0/s1
C22H28NO4P401.43581100
129147016

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C22H28NO4P/c23-22(15-27-28(24,25)26)11-10-21(14-22)20-9-8-18-12-17(6-7-19(18)13-20)16-4-2-1-3-5-16/h1-5,8-9,13,17,21H,6-7,10-12,14-15,23H2,(H2,24,25,26)/t17-,21+,22-/m1/s1
C22H28NO4P401.43581100

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