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 6 results

Search term: DSSFDBDJROTIDD (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
116146

12 of 15 defined stereocentres - 12/15 defined
InChI=1/C19H34O16/c1-30-19-16(35-18-14(29)12(27)9(24)6(3-21)32-18)15(10(25)7(4-22)33-19)34-17-13(28)11(26)8(23)5(2-20)31-17/h5-29H,2-4H2,1H3/t5-,6-,7-,8-,9+,10-,11+,12+,13-,14-,15+,16-,17?,18?,19?/m1/s1
C19H34O16518.46374400
8273638

15 of 15 defined stereocentres - 15/15 defined
InChI=1/C19H34O16/c1-30-19-16(35-18-14(29)12(27)9(24)6(3-21)32-18)15(10(25)7(4-22)33-19)34-17-13(28)11(26)8(23)5(2-20)31-17/h5-29H,2-4H2,1H3/t5-,6-,7-,8+,9+,10-,11+,12+,13-,14-,15+,16+,17-,18+,19+/m1/s1
C19H34O16518.46372100
8705306

15 of 15 defined stereocentres - 15/15 defined
InChI=1/C19H34O16/c1-30-19-16(35-18-14(29)12(27)9(24)6(3-21)32-18)15(10(25)7(4-22)33-19)34-17-13(28)11(26)8(23)5(2-20)31-17/h5-29H,2-4H2,1H3/t5-,6-,7-,8-,9-,10-,11+,12+,13-,14-,15+,16+,17+,18+,19+/m1/s1
C19H34O16518.46372100
8753201

15 of 15 defined stereocentres - 15/15 defined
InChI=1/C19H34O16/c1-30-19-16(35-18-14(29)12(27)9(24)6(3-21)32-18)15(10(25)7(4-22)33-19)34-17-13(28)11(26)8(23)5(2-20)31-17/h5-29H,2-4H2,1H3/t5-,6-,7-,8-,9-,10-,11+,12+,13-,14-,15+,16-,17+,18+,19+/m1/s1
C19H34O16518.46372200
8919949

15 of 15 defined stereocentres - 15/15 defined

Non-standard isotope
InChI=1/C19H34O16/c1-30-19-16(35-18-14(29)12(27)9(24)6(3-21)32-18)15(10(25)7(4-22)33-19)34-17-13(28)11(26)8(23)5(2-20)31-17/h5-29H,2-4H2,1H3/t5-,6-,7-,8-,9-,10-,11+,12+,13-,14-,15+,16+,17+,18+,19+/m1/s1/i3D2,9D,12D,14D,18D
C19H28D6O16524.50062200
19982942

15 of 15 defined stereocentres - 15/15 defined
InChI=1/C19H34O16/c1-30-19-16(35-18-14(29)12(27)9(24)6(3-21)32-18)15(10(25)7(4-22)33-19)34-17-13(28)11(26)8(23)5(2-20)31-17/h5-29H,2-4H2,1H3/t5-,6-,7-,8-,9+,10-,11+,12+,13-,14-,15+,16-,17+,18-,19+/m1/s1
C19H34O16518.46371100

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