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: PYSYLSJNXLAYRQ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2427692

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H29N7O/c1-15-7-8-16-14-18(22(30)23-19(16)13-15)20(28-11-9-27(2)10-12-28)21-24-25-26-29(21)17-5-3-4-6-17/h7-8,13-14,17,20H,3-6,9-12H2,1-2H3,(H,23,30)
C22H29N7O407.5129400
973553

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H29N7O/c1-15-7-8-16-14-18(22(30)23-19(16)13-15)20(28-11-9-27(2)10-12-28)21-24-25-26-29(21)17-5-3-4-6-17/h7-8,13-14,17,20H,3-6,9-12H2,1-2H3,(H,23,30)/t20-/m0/s1
C22H29N7O407.5122100
973555

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H29N7O/c1-15-7-8-16-14-18(22(30)23-19(16)13-15)20(28-11-9-27(2)10-12-28)21-24-25-26-29(21)17-5-3-4-6-17/h7-8,13-14,17,20H,3-6,9-12H2,1-2H3,(H,23,30)/t20-/m1/s1
C22H29N7O407.5122100
5341571

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H29N7O/c1-15-7-8-16-14-18(22(30)23-19(16)13-15)20(28-11-9-27(2)10-12-28)21-24-25-26-29(21)17-5-3-4-6-17/h7-8,13-14,17,20H,3-6,9-12H2,1-2H3,(H,23,30)/p+2/t20-/m0/s1
C22H31N7O409.52671100
5341572

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H29N7O/c1-15-7-8-16-14-18(22(30)23-19(16)13-15)20(28-11-9-27(2)10-12-28)21-24-25-26-29(21)17-5-3-4-6-17/h7-8,13-14,17,20H,3-6,9-12H2,1-2H3,(H,23,30)/p+2/t20-/m1/s1
C22H31N7O409.52671100

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