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: JOAZJOVQDQAYPR (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8112077

12 of 12 defined stereocentres - 12/12 defined
InChI=1/C31H50O6/c1-17(2)9-8-10-20(28(35)36)26-22-15-24(34)27-29(5)13-12-23(33)18(3)21(29)11-14-30(27,6)31(22,7)16-25(26)37-19(4)32/h9,18,20-27,33-34H,8,10-16H2,1-7H3,(H,35,36)/t18-,20-,21-,22-,23+,24+,25-,26+,27-,29-,30-,31-/m0/s1
C31H50O6518.72512100
8250851

10 of 12 defined stereocentres - 10/12 defined
InChI=1/C31H50O6/c1-17(2)9-8-10-20(28(35)36)26-22-15-24(34)27-29(5)13-12-23(33)18(3)21(29)11-14-30(27,6)31(22,7)16-25(26)37-19(4)32/h9,18,20-27,33-34H,8,10-16H2,1-7H3,(H,35,36)/t18-,20-,21?,22?,23+,24+,25-,26+,27-,29-,30-,31-/m0/s1
C31H50O6518.72512100
9213788

10 of 12 defined stereocentres - 10/12 defined
InChI=1/C31H50O6/c1-17(2)9-8-10-20(28(35)36)26-22-15-24(34)27-29(5)13-12-23(33)18(3)21(29)11-14-30(27,6)31(22,7)16-25(26)37-19(4)32/h9,18,20-27,33-34H,8,10-16H2,1-7H3,(H,35,36)/t18-,20+,21?,22?,23+,24+,25-,26+,27-,29-,30-,31-/m0/s1
C31H50O6518.72512100
4425338

0 of 12 defined stereocentres - 0/12 defined
InChI=1/C31H50O6/c1-17(2)9-8-10-20(28(35)36)26-22-15-24(34)27-29(5)13-12-23(33)18(3)21(29)11-14-30(27,6)31(22,7)16-25(26)37-19(4)32/h9,18,20-27,33-34H,8,10-16H2,1-7H3,(H,35,36)
C31H50O6518.72512100
8092819

7 of 12 defined stereocentres - 7/12 defined
InChI=1/C31H50O6/c1-17(2)9-8-10-20(28(35)36)26-22-15-24(34)27-29(5)13-12-23(33)18(3)21(29)11-14-30(27,6)31(22,7)16-25(26)37-19(4)32/h9,18,20-27,33-34H,8,10-16H2,1-7H3,(H,35,36)/t18-,20?,21?,22-,23+,24+,25?,26?,27?,29-,30-,31-/m0/s1
C31H50O6518.72511100
28512457

6 of 12 defined stereocentres - 6/12 defined
InChI=1/C31H50O6/c1-17(2)9-8-10-20(28(35)36)26-22-15-24(34)27-29(5)13-12-23(33)18(3)21(29)11-14-30(27,6)31(22,7)16-25(26)37-19(4)32/h9,18,20-27,33-34H,8,10-16H2,1-7H3,(H,35,36)/t18?,20-,21?,22?,23?,24?,25+,26?,27+,29+,30+,31+/m1/s1
C31H50O6518.72511100
28521549

6 of 12 defined stereocentres - 6/12 defined
InChI=1/C31H50O6/c1-17(2)9-8-10-20(28(35)36)26-22-15-24(34)27-29(5)13-12-23(33)18(3)21(29)11-14-30(27,6)31(22,7)16-25(26)37-19(4)32/h9,18,20-27,33-34H,8,10-16H2,1-7H3,(H,35,36)/t18?,20-,21?,22?,23?,24?,25-,26?,27-,29-,30+,31-/m0/s1
C31H50O6518.72511100

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