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 4 results

Search term: SOSKZHPSLWUECB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4593270

8 of 12 defined stereocentres - 8/12 defined
InChI=1/C31H52O5/c1-8-21(17(2)3)29(35)28(34)18(4)23-9-10-24-22-16-27(33)26-15-20(36-19(5)32)11-13-31(26,7)25(22)12-14-30(23,24)6/h17-18,20-26,28-29,34-35H,8-16H2,1-7H3/t18-,20-,21-,22?,23?,24?,25?,26+,28+,29+,30+,31+/m0/s1
C31H52O5504.74163200
8777003

12 of 12 defined stereocentres - 12/12 defined
InChI=1/C31H52O5/c1-8-21(17(2)3)29(35)28(34)18(4)23-9-10-24-22-16-27(33)26-15-20(36-19(5)32)11-13-31(26,7)25(22)12-14-30(23,24)6/h17-18,20-26,28-29,34-35H,8-16H2,1-7H3/t18-,20-,21-,22-,23+,24-,25-,26+,28+,29+,30+,31+/m0/s1
C31H52O5504.74163200
4881481

9 of 12 defined stereocentres - 9/12 defined
InChI=1/C31H52O5/c1-8-21(17(2)3)29(35)28(34)18(4)23-9-10-24-22-16-27(33)26-15-20(36-19(5)32)11-13-31(26,7)25(22)12-14-30(23,24)6/h17-18,20-26,28-29,34-35H,8-16H2,1-7H3/t18-,20-,21-,22?,23+,24?,25?,26+,28-,29-,30+,31+/m0/s1
C31H52O5504.74162200
34519711

12 of 12 defined stereocentres - 12/12 defined
InChI=1/C31H52O5/c1-8-21(17(2)3)29(35)28(34)18(4)23-9-10-24-22-16-27(33)26-15-20(36-19(5)32)11-13-31(26,7)25(22)12-14-30(23,24)6/h17-18,20-26,28-29,34-35H,8-16H2,1-7H3/t18-,20-,21-,22-,23+,24-,25-,26+,28-,29-,30+,31+/m0/s1
C31H52O5504.74161100

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