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 6 results

Search term: IJDXBTKKTDHRMD (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
64808804

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H42O4/c1-17(2)9-8-10-18(3)19-13-14-25(4)15-22-23-20(11-12-21(19)25)24(29-6)31-27(23,30-7)16-26(22,5)28/h8-11,18-19,21-24,28H,12-16H2,1-7H3/b10-8-,20-11+/t18-,19+,21-,22-,23-,24+,25+,26+,27+/m0/s1
C27H42O4430.624500
64808805

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H42O4/c1-17(2)9-8-10-18(3)19-13-14-25(4)15-22-23-20(11-12-21(19)25)24(29-6)31-27(23,30-7)16-26(22,5)28/h8-11,18-19,21-24,28H,12-16H2,1-7H3/b10-8-,20-11+/t18-,19+,21-,22-,23-,24-,25+,26+,27+/m0/s1
C27H42O4430.624500
64808806

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H42O4/c1-17(2)9-8-10-18(3)19-13-14-25(4)15-22-23-20(11-12-21(19)25)24(29-6)31-27(23,30-7)16-26(22,5)28/h8-11,18-19,21-24,28H,12-16H2,1-7H3/b10-8-,20-11+/t18-,19+,21-,22-,23+,24+,25+,26+,27-/m0/s1
C27H42O4430.624500
28488940

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H42O4/c1-17(2)9-8-10-18(3)19-13-14-25(4)15-22-23-20(11-12-21(19)25)24(29-6)31-27(23,30-7)16-26(22,5)28/h8-11,18-19,21-24,28H,12-16H2,1-7H3/b10-8-,20-11+/t18-,19+,21-,22-,23+,24-,25+,26+,27-/m0/s1
C27H42O4430.622200
29215319

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H42O4/c1-17(2)9-8-10-18(3)19-13-14-25(4)15-22-23-20(11-12-21(19)25)24(29-6)31-27(23,30-7)16-26(22,5)28/h8-11,18-19,21-24,28H,12-16H2,1-7H3/b10-8+,20-11+/t18-,19+,21-,22-,23+,24-,25+,26+,27-/m0/s1
C27H42O4430.622200
29215320

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C27H42O4/c1-17(2)9-8-10-18(3)19-13-14-25(4)15-22-23-20(11-12-21(19)25)24(29-6)31-27(23,30-7)16-26(22,5)28/h8-11,18-19,21-24,28H,12-16H2,1-7H3/b10-8+,20-11+/t18-,19+,21-,22-,23-,24-,25+,26+,27-/m0/s1
C27H42O4430.622200

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