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 9 results

Search term: YZCAXCLLBWHFLS (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4585145

Double-bond stereo

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C22H30O8/c1-6-11(2)21(26)29-18-7-12(3)16(25)9-17(28-14(5)24)15(10-23)8-19-20(18)13(4)22(27)30-19/h7-8,11,16-20,23,25H,4,6,9-10H2,1-3,5H3/b12-7+,15-8+
C22H30O8422.46883400
4953568

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C22H30O8/c1-6-11(2)21(26)29-18-7-12(3)16(25)9-17(28-14(5)24)15(10-23)8-19-20(18)13(4)22(27)30-19/h7-8,11,16-20,23,25H,4,6,9-10H2,1-3,5H3/b12-7-,15-8-/t11-,16+,17+,18-,19-,20-/m0/s1
C22H30O8422.46883300
5145160

Double-bond stereo

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C22H30O8/c1-6-11(2)21(26)29-18-7-12(3)16(25)9-17(28-14(5)24)15(10-23)8-19-20(18)13(4)22(27)30-19/h7-8,11,16-20,23,25H,4,6,9-10H2,1-3,5H3/t11-,16+,17-,18?,19+,20+/m1/s1
C22H30O8422.46882100
381527

Double-bond stereo

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C22H30O8/c1-6-11(2)21(26)29-18-7-12(3)16(25)9-17(28-14(5)24)15(10-23)8-19-20(18)13(4)22(27)30-19/h7-8,11,16-20,23,25H,4,6,9-10H2,1-3,5H3
C22H30O8422.46882100
62693613

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C22H30O8/c1-6-11(2)21(26)29-18-7-12(3)16(25)9-17(28-14(5)24)15(10-23)8-19-20(18)13(4)22(27)30-19/h7-8,11,16-20,23,25H,4,6,9-10H2,1-3,5H3/b12-7-,15-8-/t11-,16+,17-,18-,19+,20+/m1/s1
C22H30O8422.46882200
4572520

Double-bond stereo

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C22H30O8/c1-6-11(2)21(26)29-18-7-12(3)16(25)9-17(28-14(5)24)15(10-23)8-19-20(18)13(4)22(27)30-19/h7-8,11,16-20,23,25H,4,6,9-10H2,1-3,5H3/b12-7-,15-8-/t11-,16-,17-,18+,19?,20+/m0/s1
C22H30O8422.46881100
34525870

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C22H30O8/c1-6-11(2)21(26)29-18-7-12(3)16(25)9-17(28-14(5)24)15(10-23)8-19-20(18)13(4)22(27)30-19/h7-8,11,16-20,23,25H,4,6,9-10H2,1-3,5H3/b12-7-,15-8-/t11-,16-,17+,18-,19-,20-/m0/s1
C22H30O8422.46881100
57430218

Double-bond stereo

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C22H30O8/c1-6-11(2)21(26)29-18-7-12(3)16(25)9-17(28-14(5)24)15(10-23)8-19-20(18)13(4)22(27)30-19/h7-8,11,16-20,23,25H,4,6,9-10H2,1-3,5H3/b12-7-,15-8-/t11-,16+,17-,18+,19?,20+/m0/s1
C22H30O8422.46881100

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