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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 12 results

Search term: NISNRXHXSLWTHW (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
17468534

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H43NO6/c1-24(2,32)10-9-23(31)27(5,33)22-7-6-16-15-12-19(28-34)18-13-20(29)21(30)14-26(18,4)17(15)8-11-25(16,22)3/h6,12,17-18,20-23,29-34H,7-11,13-14H2,1-5H3/b28-19+/t17-,18-,20+,21-,22-,23+,25-,26+,27+/m0/s1
C27H43NO6477.63348600
7907274

Double-bond stereo

0 of 9 defined stereocentres - 0/9 defined
InChI=1/C27H43NO6/c1-24(2,32)10-9-23(31)27(5,33)22-7-6-16-15-12-19(28-34)18-13-20(29)21(30)14-26(18,4)17(15)8-11-25(16,22)3/h6,12,17-18,20-23,29-34H,7-11,13-14H2,1-5H3/b28-19+
C27H43NO6477.63343100
2967495

Double-bond stereo

0 of 9 defined stereocentres - 0/9 defined
InChI=1/C27H43NO6/c1-24(2,32)10-9-23(31)27(5,33)22-7-6-16-15-12-19(28-34)18-13-20(29)21(30)14-26(18,4)17(15)8-11-25(16,22)3/h6,12,17-18,20-23,29-34H,7-11,13-14H2,1-5H3
C27H43NO6477.633422100
62317305

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H43NO6/c1-24(2,32)10-9-23(31)27(5,33)22-7-6-16-15-12-19(28-34)18-13-20(29)21(30)14-26(18,4)17(15)8-11-25(16,22)3/h6,12,17-18,20-23,29-34H,7-11,13-14H2,1-5H3/b28-19+/t17-,18-,20-,21+,22+,23-,25+,26-,27+/m1/s1
C27H43NO6477.63342200
62317306

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H43NO6/c1-24(2,32)10-9-23(31)27(5,33)22-7-6-16-15-12-19(28-34)18-13-20(29)21(30)14-26(18,4)17(15)8-11-25(16,22)3/h6,12,17-18,20-23,29-34H,7-11,13-14H2,1-5H3/b28-19+/t17-,18+,20+,21-,22-,23+,25-,26+,27-/m0/s1
C27H43NO6477.63342300
62490682

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H43NO6/c1-24(2,32)10-9-23(31)27(5,33)22-7-6-16-15-12-19(28-34)18-13-20(29)21(30)14-26(18,4)17(15)8-11-25(16,22)3/h6,12,17-18,20-23,29-34H,7-11,13-14H2,1-5H3/b28-19+/t17-,18-,20-,21+,22+,23-,25-,26-,27+/m1/s1
C27H43NO6477.63342200
62569862

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H43NO6/c1-24(2,32)10-9-23(31)27(5,33)22-7-6-16-15-12-19(28-34)18-13-20(29)21(30)14-26(18,4)17(15)8-11-25(16,22)3/h6,12,17-18,20-23,29-34H,7-11,13-14H2,1-5H3/b28-19+/t17-,18+,20-,21+,22-,23-,25-,26+,27+/m1/s1
C27H43NO6477.63342400
62570932

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H43NO6/c1-24(2,32)10-9-23(31)27(5,33)22-7-6-16-15-12-19(28-34)18-13-20(29)21(30)14-26(18,4)17(15)8-11-25(16,22)3/h6,12,17-18,20-23,29-34H,7-11,13-14H2,1-5H3/b28-19+/t17-,18+,20+,21-,22-,23+,25+,26+,27-/m0/s1
C27H43NO6477.63342200
62570937

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H43NO6/c1-24(2,32)10-9-23(31)27(5,33)22-7-6-16-15-12-19(28-34)18-13-20(29)21(30)14-26(18,4)17(15)8-11-25(16,22)3/h6,12,17-18,20-23,29-34H,7-11,13-14H2,1-5H3/b28-19-/t17-,18+,20-,21+,22-,23+,25-,26+,27+/m1/s1
C27H43NO6477.63342200
62570938

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H43NO6/c1-24(2,32)10-9-23(31)27(5,33)22-7-6-16-15-12-19(28-34)18-13-20(29)21(30)14-26(18,4)17(15)8-11-25(16,22)3/h6,12,17-18,20-23,29-34H,7-11,13-14H2,1-5H3/b28-19-/t17-,18+,20-,21+,22-,23-,25-,26+,27-/m1/s1
C27H43NO6477.63342200
62570939

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H43NO6/c1-24(2,32)10-9-23(31)27(5,33)22-7-6-16-15-12-19(28-34)18-13-20(29)21(30)14-26(18,4)17(15)8-11-25(16,22)3/h6,12,17-18,20-23,29-34H,7-11,13-14H2,1-5H3/b28-19-/t17-,18+,20-,21+,22-,23+,25-,26+,27-/m1/s1
C27H43NO6477.63342200
62384079

Double-bond stereo

0 of 9 defined stereocentres - 0/9 defined
InChI=1/C27H43NO6/c1-24(2,32)10-9-23(31)27(5,33)22-7-6-16-15-12-19(28-34)18-13-20(29)21(30)14-26(18,4)17(15)8-11-25(16,22)3/h6,12,17-18,20-23,29-34H,7-11,13-14H2,1-5H3/b28-19+/t17-,18-,20-,21+,22-,23-,25-,26+,27-/m1/s1
C27H43NO6477.63341100

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