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 9 results

Search term: KNNBNGASMJWSSX (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2657345

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C25H43NO3/c1-7-28-22-9-8-21(16-23(22)27-6)18-26-14-12-25(11-10-19(2)3)13-15-29-24(17-25)20(4)5/h8-9,16,19-20,24,26H,7,10-15,17-18H2,1-6H3
C25H43NO3405.613815900
5441367

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C25H43NO3/c1-7-28-22-9-8-21(16-23(22)27-6)18-26-14-12-25(11-10-19(2)3)13-15-29-24(17-25)20(4)5/h8-9,16,19-20,24,26H,7,10-15,17-18H2,1-6H3/t24-,25+/m0/s1
C25H43NO3405.61382100
5441369

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C25H43NO3/c1-7-28-22-9-8-21(16-23(22)27-6)18-26-14-12-25(11-10-19(2)3)13-15-29-24(17-25)20(4)5/h8-9,16,19-20,24,26H,7,10-15,17-18H2,1-6H3/t24-,25-/m0/s1
C25H43NO3405.61382100
5441371

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C25H43NO3/c1-7-28-22-9-8-21(16-23(22)27-6)18-26-14-12-25(11-10-19(2)3)13-15-29-24(17-25)20(4)5/h8-9,16,19-20,24,26H,7,10-15,17-18H2,1-6H3/t24-,25-/m1/s1
C25H43NO3405.61382100
5441373

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C25H43NO3/c1-7-28-22-9-8-21(16-23(22)27-6)18-26-14-12-25(11-10-19(2)3)13-15-29-24(17-25)20(4)5/h8-9,16,19-20,24,26H,7,10-15,17-18H2,1-6H3/t24-,25+/m1/s1
C25H43NO3405.61382100
5441372

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C25H43NO3/c1-7-28-22-9-8-21(16-23(22)27-6)18-26-14-12-25(11-10-19(2)3)13-15-29-24(17-25)20(4)5/h8-9,16,19-20,24,26H,7,10-15,17-18H2,1-6H3/p+1/t24-,25+/m1/s1
C25H44NO3406.62121100
5441370

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C25H43NO3/c1-7-28-22-9-8-21(16-23(22)27-6)18-26-14-12-25(11-10-19(2)3)13-15-29-24(17-25)20(4)5/h8-9,16,19-20,24,26H,7,10-15,17-18H2,1-6H3/p+1/t24-,25-/m1/s1
C25H44NO3406.62121100
5441368

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C25H43NO3/c1-7-28-22-9-8-21(16-23(22)27-6)18-26-14-12-25(11-10-19(2)3)13-15-29-24(17-25)20(4)5/h8-9,16,19-20,24,26H,7,10-15,17-18H2,1-6H3/p+1/t24-,25-/m0/s1
C25H44NO3406.62121100
5441366

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C25H43NO3/c1-7-28-22-9-8-21(16-23(22)27-6)18-26-14-12-25(11-10-19(2)3)13-15-29-24(17-25)20(4)5/h8-9,16,19-20,24,26H,7,10-15,17-18H2,1-6H3/p+1/t24-,25+/m0/s1
C25H44NO3406.62121100

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