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 5 results

Search term: AWUANSRDROHJEI (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
23161866

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C38H44O12/c1-20-25(48-34(45)24(40)16-22-12-8-6-9-13-22)18-38(46)32(49-33(44)23-14-10-7-11-15-23)30-36(5,31(43)29(42)28(20)35(38,3)4)26(41)17-27-37(30,19-47-27)50-21(2)39/h6-15,24-27,29-30,32,40-42,46H,16-19H2,1-5H3/t24-,25+,26+,27-,29-,30+,32+,36-,37+,38-/m1/s1
C38H44O12692.74882200
23162008

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C38H44O12/c1-20-25(48-34(45)24(40)16-22-12-8-6-9-13-22)18-38(46)32(49-33(44)23-14-10-7-11-15-23)30-36(5,31(43)29(42)28(20)35(38,3)4)26(41)17-27-37(30,19-47-27)50-21(2)39/h6-15,24-27,29-30,32,40-42,46H,16-19H2,1-5H3/t24-,25-,26-,27+,29+,30-,32-,36+,37-,38+/m0/s1
C38H44O12692.74882200
23213312

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C38H44O12/c1-20-25(48-34(45)24(40)16-22-12-8-6-9-13-22)18-38(46)32(49-33(44)23-14-10-7-11-15-23)30-36(5,31(43)29(42)28(20)35(38,3)4)26(41)17-27-37(30,19-47-27)50-21(2)39/h6-15,24-27,29-30,32,40-42,46H,16-19H2,1-5H3/t24-,25+,26+,27?,29-,30+,32+,36-,37+,38-/m1/s1
C38H44O12692.74882200
23213366

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C38H44O12/c1-20-25(48-34(45)24(40)16-22-12-8-6-9-13-22)18-38(46)32(49-33(44)23-14-10-7-11-15-23)30-36(5,31(43)29(42)28(20)35(38,3)4)26(41)17-27-37(30,19-47-27)50-21(2)39/h6-15,24-27,29-30,32,40-42,46H,16-19H2,1-5H3/t24-,25-,26-,27?,29+,30-,32-,36+,37-,38+/m0/s1
C38H44O12692.74882200
23243196

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C38H44O12/c1-20-25(48-34(45)24(40)16-22-12-8-6-9-13-22)18-38(46)32(49-33(44)23-14-10-7-11-15-23)30-36(5,31(43)29(42)28(20)35(38,3)4)26(41)17-27-37(30,19-47-27)50-21(2)39/h6-15,24-27,29-30,32,40-42,46H,16-19H2,1-5H3/t24?,25-,26-,27+,29+,30-,32-,36+,37-,38+/m0/s1
C38H44O12692.74882200

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