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
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Found 6 results

Search term: WUVVKZOGORTHGC (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3830379

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C25H33NO3/c1-25(2)17-20(14-16-29-25)22(23-7-5-6-8-24(23)28-4)13-15-26-18-19-9-11-21(27-3)12-10-19/h5-12,18,20,22H,13-17H2,1-4H3/b26-18+
C25H33NO3395.534415800
5429489

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C25H33NO3/c1-25(2)17-20(14-16-29-25)22(23-7-5-6-8-24(23)28-4)13-15-26-18-19-9-11-21(27-3)12-10-19/h5-12,18,20,22H,13-17H2,1-4H3/b26-18+/t20-,22-/m1/s1
C25H33NO3395.53442100
5429490

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C25H33NO3/c1-25(2)17-20(14-16-29-25)22(23-7-5-6-8-24(23)28-4)13-15-26-18-19-9-11-21(27-3)12-10-19/h5-12,18,20,22H,13-17H2,1-4H3/b26-18+/t20-,22+/m0/s1
C25H33NO3395.53442100
5429491

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C25H33NO3/c1-25(2)17-20(14-16-29-25)22(23-7-5-6-8-24(23)28-4)13-15-26-18-19-9-11-21(27-3)12-10-19/h5-12,18,20,22H,13-17H2,1-4H3/b26-18+/t20-,22+/m1/s1
C25H33NO3395.53442100
5429492

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C25H33NO3/c1-25(2)17-20(14-16-29-25)22(23-7-5-6-8-24(23)28-4)13-15-26-18-19-9-11-21(27-3)12-10-19/h5-12,18,20,22H,13-17H2,1-4H3/b26-18+/t20-,22-/m0/s1
C25H33NO3395.53442100

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