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: UNXQMRVMBDHLTF (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4756122

Double-bond stereo

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C27H36O5/c1-7-8-19(28)16(3)17-13-20(29)18-14-26(6)15(2)9-10-21-25(4,5)22(30)11-12-27(21,26)32-24(18)23(17)31/h7-8,13,15-16,21-22,30H,9-12,14H2,1-6H3/b8-7+
C27H36O5440.57173300
4947374

Double-bond stereo

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C27H36O5/c1-7-8-19(28)16(3)17-13-20(29)18-14-26(6)15(2)9-10-21-25(4,5)22(30)11-12-27(21,26)32-24(18)23(17)31/h7-8,13,15-16,21-22,30H,9-12,14H2,1-6H3/b8-7+/t15-,16-,21-,22-,26+,27?/m0/s1
C27H36O5440.57173200
8156279

Double-bond stereo

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C27H36O5/c1-7-8-19(28)16(3)17-13-20(29)18-14-26(6)15(2)9-10-21-25(4,5)22(30)11-12-27(21,26)32-24(18)23(17)31/h7-8,13,15-16,21-22,30H,9-12,14H2,1-6H3/b8-7+/t15-,16-,21-,22?,26+,27-/m0/s1
C27H36O5440.57172100
10143266

Double-bond stereo

3 of 6 defined stereocentres - 3/6 defined
InChI=1/C27H36O5/c1-7-8-19(28)16(3)17-13-20(29)18-14-26(6)15(2)9-10-21-25(4,5)22(30)11-12-27(21,26)32-24(18)23(17)31/h7-8,13,15-16,21-22,30H,9-12,14H2,1-6H3/t15-,16?,21-,22-,26?,27?/m0/s1
C27H36O5440.57172100
433035

Double-bond stereo

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C27H36O5/c1-7-8-19(28)16(3)17-13-20(29)18-14-26(6)15(2)9-10-21-25(4,5)22(30)11-12-27(21,26)32-24(18)23(17)31/h7-8,13,15-16,21-22,30H,9-12,14H2,1-6H3
C27H36O5440.57172100
58816478

Double-bond stereo

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C27H36O5/c1-7-8-19(28)16(3)17-13-20(29)18-14-26(6)15(2)9-10-21-25(4,5)22(30)11-12-27(21,26)32-24(18)23(17)31/h7-8,13,15-16,21-22,30H,9-12,14H2,1-6H3/b8-7+/t15-,16-,21-,22-,26?,27?/m0/s1
C27H36O5440.57171100
75570368

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C27H36O5/c1-7-8-19(28)16(3)17-13-20(29)18-14-26(6)15(2)9-10-21-25(4,5)22(30)11-12-27(21,26)32-24(18)23(17)31/h7-8,13,15-16,21-22,30H,9-12,14H2,1-6H3/b8-7+/t15-,16-,21-,22-,26+,27-/m0/s1
C27H36O5440.57171100

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