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 4 results

Search term: YGVSXBZEAAVPKZ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2790177

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C34H42ClN3O5/c1-3-36-33(40)37-20-24-4-10-27(11-5-24)32-42-30(23(2)31(43-32)26-8-6-25(22-39)7-9-26)21-38-18-16-34(41,17-19-38)28-12-14-29(35)15-13-28/h4-15,23,30-32,39,41H,3,16-22H2,1-2H3,(H2,36,37,40)
C34H42ClN3O5608.1673799999982100
5112535

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C34H42ClN3O5/c1-3-36-33(40)37-20-24-4-10-27(11-5-24)32-42-30(23(2)31(43-32)26-8-6-25(22-39)7-9-26)21-38-18-16-34(41,17-19-38)28-12-14-29(35)15-13-28/h4-15,23,30-32,39,41H,3,16-22H2,1-2H3,(H2,36,37,40)/t23-,30+,31+,32?/m0/s1
C34H42ClN3O5608.16742100
5118774

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C34H42ClN3O5/c1-3-36-33(40)37-20-24-4-10-27(11-5-24)32-42-30(23(2)31(43-32)26-8-6-25(22-39)7-9-26)21-38-18-16-34(41,17-19-38)28-12-14-29(35)15-13-28/h4-15,23,30-32,39,41H,3,16-22H2,1-2H3,(H2,36,37,40)/t23-,30+,31+,32+/m0/s1
C34H42ClN3O5608.16742100
5124520

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C34H42ClN3O5/c1-3-36-33(40)37-20-24-4-10-27(11-5-24)32-42-30(23(2)31(43-32)26-8-6-25(22-39)7-9-26)21-38-18-16-34(41,17-19-38)28-12-14-29(35)15-13-28/h4-15,23,30-32,39,41H,3,16-22H2,1-2H3,(H2,36,37,40)/t23-,30+,31+,32+/m1/s1
C34H42ClN3O5608.16742100

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