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 7 results

Search term: RVWGLBNUTMYAOL (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
59693836

Double-bond stereo

8 of 10 defined stereocentres - 8/10 defined
InChI=1/C28H46O3/c1-17(2)18(3)7-8-19(4)21-11-12-22-23-10-9-20-15-24(29)25(30)16-27(20,6)28(23,31)14-13-26(21,22)5/h7-8,10,17-22,24-25,29-31H,9,11-16H2,1-6H3/b8-7+/t18-,19+,20?,21+,22?,24-,25-,26+,27-,28+/m0/s1
C28H46O3430.6634400
4943819

Double-bond stereo

6 of 10 defined stereocentres - 6/10 defined
InChI=1/C28H46O3/c1-17(2)18(3)7-8-19(4)21-11-12-22-23-10-9-20-15-24(29)25(30)16-27(20,6)28(23,31)14-13-26(21,22)5/h7-8,10,17-22,24-25,29-31H,9,11-16H2,1-6H3/b8-7+/t18-,19+,20?,21+,22-,24?,25?,26+,27-,28?/m0/s1
C28H46O3430.6632200
8495963

Double-bond stereo

4 of 10 defined stereocentres - 4/10 defined
InChI=1/C28H46O3/c1-17(2)18(3)7-8-19(4)21-11-12-22-23-10-9-20-15-24(29)25(30)16-27(20,6)28(23,31)14-13-26(21,22)5/h7-8,10,17-22,24-25,29-31H,9,11-16H2,1-6H3/b8-7+/t18-,19+,20?,21?,22?,24-,25?,26?,27?,28+/m0/s1
C28H46O3430.6632100
23339113

Double-bond stereo

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C28H46O3/c1-17(2)18(3)7-8-19(4)21-11-12-22-23-10-9-20-15-24(29)25(30)16-27(20,6)28(23,31)14-13-26(21,22)5/h7-8,10,17-22,24-25,29-31H,9,11-16H2,1-6H3/b8-7+/t18-,19+,20-,21+,22-,24-,25-,26+,27-,28+/m0/s1
C28H46O3430.6632200
20144019

Double-bond stereo

7 of 10 defined stereocentres - 7/10 defined
InChI=1/C28H46O3/c1-17(2)18(3)7-8-19(4)21-11-12-22-23-10-9-20-15-24(29)25(30)16-27(20,6)28(23,31)14-13-26(21,22)5/h7-8,10,17-22,24-25,29-31H,9,11-16H2,1-6H3/b8-7+/t18-,19+,20?,21+,22-,24?,25?,26+,27-,28+/m0/s1
C28H46O3430.6631100
78440756

Double-bond stereo

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C28H46O3/c1-17(2)18(3)7-8-19(4)21-11-12-22-23-10-9-20-15-24(29)25(30)16-27(20,6)28(23,31)14-13-26(21,22)5/h7-8,10,17-22,24-25,29-31H,9,11-16H2,1-6H3/t18-,19+,20?,21+,22-,24-,25-,26+,27-,28+/m0/s1
C28H46O3430.6631100

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