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: NZQPZUBENICYED (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
17461864

3 of 10 defined stereocentres - 3/10 defined
InChI=1/C33H52O5/c1-7-29(34)36-19-20(3)9-12-27-21(4)31-28(38-27)18-26-24-11-10-22-17-23(37-30(35)8-2)13-15-32(22,5)25(24)14-16-33(26,31)6/h20,22-26,28,31H,7-19H2,1-6H3/t20?,22-,23?,24?,25?,26?,28?,31?,32-,33-/m0/s1
C33H52O5528.7634100
62315633

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C33H52O5/c1-7-29(34)36-19-20(3)9-12-27-21(4)31-28(38-27)18-26-24-11-10-22-17-23(37-30(35)8-2)13-15-32(22,5)25(24)14-16-33(26,31)6/h20,22-26,28,31H,7-19H2,1-6H3/t20-,22-,23-,24+,25+,26+,28+,31+,32-,33-/m0/s1
C33H52O5528.7632200
1384953

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C33H52O5/c1-7-29(34)36-19-20(3)9-12-27-21(4)31-28(38-27)18-26-24-11-10-22-17-23(37-30(35)8-2)13-15-32(22,5)25(24)14-16-33(26,31)6/h20,22-26,28,31H,7-19H2,1-6H3/t20-,22+,23+,24-,25+,26+,28-,31-,32+,33+/m1/s1
C33H52O5528.7632100
2956766

0 of 10 defined stereocentres - 0/10 defined
InChI=1/C33H52O5/c1-7-29(34)36-19-20(3)9-12-27-21(4)31-28(38-27)18-26-24-11-10-22-17-23(37-30(35)8-2)13-15-32(22,5)25(24)14-16-33(26,31)6/h20,22-26,28,31H,7-19H2,1-6H3
C33H52O5528.762982100
62530200

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C33H52O5/c1-7-29(34)36-19-20(3)9-12-27-21(4)31-28(38-27)18-26-24-11-10-22-17-23(37-30(35)8-2)13-15-32(22,5)25(24)14-16-33(26,31)6/h20,22-26,28,31H,7-19H2,1-6H3/t20-,22+,23+,24-,25-,26-,28-,31+,32+,33+/m1/s1
C33H52O5528.7632200
62341321

0 of 10 defined stereocentres - 0/10 defined
InChI=1/C33H52O5/c1-7-29(34)36-19-20(3)9-12-27-21(4)31-28(38-27)18-26-24-11-10-22-17-23(37-30(35)8-2)13-15-32(22,5)25(24)14-16-33(26,31)6/h20,22-26,28,31H,7-19H2,1-6H3/t20-,22+,23+,24-,25-,26-,28-,31-,32+,33+/m1/s1
C33H52O5528.7631100

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