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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 19 results

Search term: UBBRXVRQZJSDAK (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
30783492

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C24H28O4/c1-3-5-7-18-16-10-9-15-14-11-12-24(21(15)20(16)23(26)27-18)17(13-14)22(25)28-19(24)8-6-4-2/h7-8,13-15,21H,3-6,9-12H2,1-2H3/b18-7-,19-8-/t14-,15+,21-,24+/m1/s1
C24H28O4380.4767312800
4475823

Double-bond stereo

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C24H28O4/c1-3-5-7-18-16-10-9-15-14-11-12-24(21(15)20(16)23(26)27-18)17(13-14)22(25)28-19(24)8-6-4-2/h7-8,13-15,21H,3-6,9-12H2,1-2H3/b18-7-,19-8-/t14?,15-,21+,24?/m0/s1
C24H28O4380.47675300
9958511

Double-bond stereo

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C24H28O4/c1-3-5-7-18-16-10-9-15-14-11-12-24(21(15)20(16)23(26)27-18)17(13-14)22(25)28-19(24)8-6-4-2/h7-8,13-15,21H,3-6,9-12H2,1-2H3/b18-7-,19-8-/t14-,15?,21?,24+/m1/s1
C24H28O4380.476743112
57876282

Double-bond stereo

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C24H28O4/c1-3-5-7-18-16-10-9-15-14-11-12-24(21(15)20(16)23(26)27-18)17(13-14)22(25)28-19(24)8-6-4-2/h7-8,13-15,21H,3-6,9-12H2,1-2H3/b18-7-,19-8-/t14?,15-,21+,24-/m0/s1
C24H28O4380.47673200
82827524

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C24H28O4/c1-3-5-7-18-16-10-9-15-14-11-12-24(21(15)20(16)23(26)27-18)17(13-14)22(25)28-19(24)8-6-4-2/h7-8,13-15,21H,3-6,9-12H2,1-2H3/b18-7-,19-8-/t14-,15+,21-,24+/m0/s1
C24H28O4380.47672200
103867563

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C24H28O4/c1-3-5-7-18-16-10-9-15-14-11-12-24(21(15)20(16)23(26)27-18)17(13-14)22(25)28-19(24)8-6-4-2/h7-8,13-15,21H,3-6,9-12H2,1-2H3/t14-,15+,21-,24+/m1/s1
C24H28O4380.47672200
8105412

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C24H28O4/c1-3-5-7-18-16-10-9-15-14-11-12-24(21(15)20(16)23(26)27-18)17(13-14)22(25)28-19(24)8-6-4-2/h7-8,13-15,21H,3-6,9-12H2,1-2H3/b18-7-,19-8-/t14-,15-,21+,24-/m1/s1
C24H28O4380.47672100
26345825

Double-bond stereo

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C24H28O4/c1-3-5-7-18-16-10-9-15-14-11-12-24(21(15)20(16)23(26)27-18)17(13-14)22(25)28-19(24)8-6-4-2/h7-8,13-15,21H,3-6,9-12H2,1-2H3/b18-7+,19-8-/t14-,15+,21?,24+/m1/s1
C24H28O4380.47672200
28419508

Double-bond stereo

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C24H28O4/c1-3-5-7-18-16-10-9-15-14-11-12-24(21(15)20(16)23(26)27-18)17(13-14)22(25)28-19(24)8-6-4-2/h7-8,13-15,21H,3-6,9-12H2,1-2H3/b18-7-,19-8-
C24H28O4380.47672200
57486806

Double-bond stereo

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C24H28O4/c1-3-5-7-18-16-10-9-15-14-11-12-24(21(15)20(16)23(26)27-18)17(13-14)22(25)28-19(24)8-6-4-2/h7-8,13-15,21H,3-6,9-12H2,1-2H3/b18-7+,19-8+
C24H28O4380.47671100
10211218

Double-bond stereo

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C24H28O4/c1-3-5-7-18-16-10-9-15-14-11-12-24(21(15)20(16)23(26)27-18)17(13-14)22(25)28-19(24)8-6-4-2/h7-8,13-15,21H,3-6,9-12H2,1-2H3/b18-7+,19-8-/t14-,15?,21?,24+/m1/s1
C24H28O4380.47671100
110417996

Double-bond stereo

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C24H28O4/c1-3-5-7-18-16-10-9-15-14-11-12-24(21(15)20(16)23(26)27-18)17(13-14)22(25)28-19(24)8-6-4-2/h7-8,13-15,21H,3-6,9-12H2,1-2H3/b18-7-,19-8-/t14-,15-,21+,24?/m0/s1
C24H28O4380.47671100
113608528

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C24H28O4/c1-3-5-7-18-16-10-9-15-14-11-12-24(21(15)20(16)23(26)27-18)17(13-14)22(25)28-19(24)8-6-4-2/h7-8,13-15,21H,3-6,9-12H2,1-2H3/t14-,15+,21+,24+/m1/s1
C24H28O4380.47671100
113612063

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C24H28O4/c1-3-5-7-18-16-10-9-15-14-11-12-24(21(15)20(16)23(26)27-18)17(13-14)22(25)28-19(24)8-6-4-2/h7-8,13-15,21H,3-6,9-12H2,1-2H3/t14-,15+,21-,24-/m1/s1
C24H28O4380.47671100
114392104

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C24H28O4/c1-3-5-7-18-16-10-9-15-14-11-12-24(21(15)20(16)23(26)27-18)17(13-14)22(25)28-19(24)8-6-4-2/h7-8,13-15,21H,3-6,9-12H2,1-2H3/t14-,15+,21+,24-/m0/s1
C24H28O4380.47671100
101936474

Double-bond stereo

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C24H28O4/c1-3-5-7-18-16-10-9-15-14-11-12-24(21(15)20(16)23(26)27-18)17(13-14)22(25)28-19(24)8-6-4-2/h7-8,13-15,21H,3-6,9-12H2,1-2H3/b18-7-,19-8u/t14?,15-,21+,24?/m0/s1
C24H28O4380.47671200
60958804

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C24H28O4/c1-3-5-7-18-16-10-9-15-14-11-12-24(21(15)20(16)23(26)27-18)17(13-14)22(25)28-19(24)8-6-4-2/h7-8,13-15,21H,3-6,9-12H2,1-2H3/b18-7+,19-8+/t14-,15+,21-,24+/m1/s1
C24H28O4380.47671100

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