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 7 results

Search term: LRFYCTLMXJJJHZ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
28424502

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C17H28O3/c1-11(18)20-14-6-8-17(19)10-16(14,4)7-5-12-13(17)9-15(12,2)3/h12-14,19H,5-10H2,1-4H3/t12-,13+,14+,16+,17-/m1/s1
C17H28O3280.4024161100
3176716

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C17H28O3/c1-11(18)20-14-6-8-17(19)10-16(14,4)7-5-12-13(17)9-15(12,2)3/h12-14,19H,5-10H2,1-4H3
C17H28O3280.40247400
62558478

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C17H28O3/c1-11(18)20-14-6-8-17(19)10-16(14,4)7-5-12-13(17)9-15(12,2)3/h12-14,19H,5-10H2,1-4H3/t12-,13+,14+,16-,17+/m1/s1
C17H28O3280.40242200
113612036

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C17H28O3/c1-11(18)20-14-6-8-17(19)10-16(14,4)7-5-12-13(17)9-15(12,2)3/h12-14,19H,5-10H2,1-4H3/t12-,13-,14+,16-,17-/m0/s1
C17H28O3280.40241100
114544940

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C17H28O3/c1-11(18)20-14-6-8-17(19)10-16(14,4)7-5-12-13(17)9-15(12,2)3/h12-14,19H,5-10H2,1-4H3/t12-,13+,14+,16+,17-/m0/s1
C17H28O3280.40241100
114815420

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C17H28O3/c1-11(18)20-14-6-8-17(19)10-16(14,4)7-5-12-13(17)9-15(12,2)3/h12-14,19H,5-10H2,1-4H3/t12-,13-,14+,16-,17-/m1/s1
C17H28O3280.40241100
60599995

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C17H28O3/c1-11(18)20-14-6-8-17(19)10-16(14,4)7-5-12-13(17)9-15(12,2)3/h12-14,19H,5-10H2,1-4H3/t12-,13+,14+,16+,17+/m0/s1
C17H28O3280.40241100

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