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 7 results

Search term: NVDZRSWQWPPKAI (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
48061456

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C20H30O5/c1-9-6-12-13(19(12,4)5)7-14(21)11(3)17(23)15-16(22)10(2)8-20(15,25)18(9)24/h6,10,12-17,21-23,25H,3,7-8H2,1-2,4-5H3/b9-6-/t10-,12+,13-,14+,15+,16-,17-,20+/m0/s1
C20H30O5350.4492172100
57257046

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C20H30O5/c1-9-6-12-13(19(12,4)5)7-14(21)11(3)17(23)15-16(22)10(2)8-20(15,25)18(9)24/h6,10,12-17,21-23,25H,3,7-8H2,1-2,4-5H3/b9-6-/t10-,12+,13-,14+,15+,16-,17+,20+/m0/s1
C20H30O5350.44928600
82966026

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C20H30O5/c1-9-6-12-13(19(12,4)5)7-14(21)11(3)17(23)15-16(22)10(2)8-20(15,25)18(9)24/h6,10,12-17,21-23,25H,3,7-8H2,1-2,4-5H3/b9-6+/t10-,12+,13-,14+,15+,16-,17+,20+/m1/s1
C20H30O5350.44922200
113060371

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C20H30O5/c1-9-6-12-13(19(12,4)5)7-14(21)11(3)17(23)15-16(22)10(2)8-20(15,25)18(9)24/h6,10,12-17,21-23,25H,3,7-8H2,1-2,4-5H3/b9-6+/t10-,12+,13-,14-,15+,16-,17+,20+/m0/s1
C20H30O5350.44921100
113609759

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C20H30O5/c1-9-6-12-13(19(12,4)5)7-14(21)11(3)17(23)15-16(22)10(2)8-20(15,25)18(9)24/h6,10,12-17,21-23,25H,3,7-8H2,1-2,4-5H3/b9-6-/t10-,12-,13-,14+,15+,16-,17-,20-/m0/s1
C20H30O5350.44921100
114392163

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C20H30O5/c1-9-6-12-13(19(12,4)5)7-14(21)11(3)17(23)15-16(22)10(2)8-20(15,25)18(9)24/h6,10,12-17,21-23,25H,3,7-8H2,1-2,4-5H3/b9-6-/t10-,12-,13+,14-,15-,16-,17-,20-/m1/s1
C20H30O5350.44921100
60958991

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C20H30O5/c1-9-6-12-13(19(12,4)5)7-14(21)11(3)17(23)15-16(22)10(2)8-20(15,25)18(9)24/h6,10,12-17,21-23,25H,3,7-8H2,1-2,4-5H3/b9-6+/t10-,12+,13+,14+,15+,16-,17+,20+/m0/s1
C20H30O5350.44921100

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