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: CCXWTNLPPHXPFG (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
10189027

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C27H38O3/c1-17-8-9-19(14-21(17)29)20-10-11-23-26(5,15-20)16-22(30-18(2)28)24-25(3,4)12-7-13-27(23,24)6/h8-10,14,22-24,29H,7,11-13,15-16H2,1-6H3/t22-,23+,24+,26-,27-/m1/s1
C27H38O3410.58884413
23339497

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C27H38O3/c1-17-8-9-19(14-21(17)29)20-10-11-23-26(5,15-20)16-22(30-18(2)28)24-25(3,4)12-7-13-27(23,24)6/h8-10,14,22-24,29H,7,11-13,15-16H2,1-6H3/t22-,23-,24+,26-,27-/m1/s1
C27H38O3410.58882200
8562332

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C27H38O3/c1-17-8-9-19(14-21(17)29)20-10-11-23-26(5,15-20)16-22(30-18(2)28)24-25(3,4)12-7-13-27(23,24)6/h8-10,14,22-24,29H,7,11-13,15-16H2,1-6H3/t22-,23?,24?,26-,27-/m1/s1
C27H38O3410.58882100

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