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: UQGSIDMQNAEDIH (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4073951

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H31N5O/c1-26-10-9-17-18(12-22)21(24-15-6-3-2-4-7-15)25-20(19(17)14-26)23-13-16-8-5-11-27-16/h15-16H,2-11,13-14H2,1H3,(H2,23,24,25)
C21H31N5O369.50374141000
1446207

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H31N5O/c1-26-10-9-17-18(12-22)21(24-15-6-3-2-4-7-15)25-20(19(17)14-26)23-13-16-8-5-11-27-16/h15-16H,2-11,13-14H2,1H3,(H2,23,24,25)/t16-/m1/s1
C21H31N5O369.50372100
1446209

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H31N5O/c1-26-10-9-17-18(12-22)21(24-15-6-3-2-4-7-15)25-20(19(17)14-26)23-13-16-8-5-11-27-16/h15-16H,2-11,13-14H2,1H3,(H2,23,24,25)/t16-/m0/s1
C21H31N5O369.50372100
1446206

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H31N5O/c1-26-10-9-17-18(12-22)21(24-15-6-3-2-4-7-15)25-20(19(17)14-26)23-13-16-8-5-11-27-16/h15-16H,2-11,13-14H2,1H3,(H2,23,24,25)/p+2/t16-/m1/s1
C21H33N5O371.51851100
1446208

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H31N5O/c1-26-10-9-17-18(12-22)21(24-15-6-3-2-4-7-15)25-20(19(17)14-26)23-13-16-8-5-11-27-16/h15-16H,2-11,13-14H2,1H3,(H2,23,24,25)/p+2/t16-/m0/s1
C21H33N5O371.51851100

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