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: VSWLTXYUTUABJB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
117169

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C24H29N9O5/c1-31-9-13(6-16(31)21(34)27-5-4-20(25)26)28-22(35)17-7-14(10-32(17)2)29-23(36)18-8-15(11-33(18)3)30-24(37)19-12-38-19/h6-11,19H,4-5,12H2,1-3H3,(H3,25,26)(H,27,34)(H,28,35)(H,29,36)(H,30,37)
C24H29N9O5523.54449800
8159848

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C24H29N9O5/c1-31-9-13(6-16(31)21(34)27-5-4-20(25)26)28-22(35)17-7-14(10-32(17)2)29-23(36)18-8-15(11-33(18)3)30-24(37)19-12-38-19/h6-11,19H,4-5,12H2,1-3H3,(H3,25,26)(H,27,34)(H,28,35)(H,29,36)(H,30,37)/t19-/m1/s1
C24H29N9O5523.54442100
8567480

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C24H29N9O5/c1-31-9-13(6-16(31)21(34)27-5-4-20(25)26)28-22(35)17-7-14(10-32(17)2)29-23(36)18-8-15(11-33(18)3)30-24(37)19-12-38-19/h6-11,19H,4-5,12H2,1-3H3,(H3,25,26)(H,27,34)(H,28,35)(H,29,36)(H,30,37)/t19-/m0/s1
C24H29N9O5523.54442100

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