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: TZZHURFSCIIOSG (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
57257112

11 of 11 defined stereocentres - 11/11 defined
InChI=1/C32H50O5/c1-18(2)20-11-14-32(27(35)36)16-15-30(7)21(25(20)32)9-10-24-29(6)17-22(34)26(37-19(3)33)28(4,5)23(29)12-13-31(24,30)8/h20-26,34H,1,9-17H2,2-8H3,(H,35,36)/t20-,21+,22+,23-,24+,25+,26-,29-,30+,31+,32-/m0/s1
C32H50O5514.736410800
57971854

0 of 11 defined stereocentres - 0/11 defined
InChI=1/C32H50O5/c1-18(2)20-11-14-32(27(35)36)16-15-30(7)21(25(20)32)9-10-24-29(6)17-22(34)26(37-19(3)33)28(4,5)23(29)12-13-31(24,30)8/h20-26,34H,1,9-17H2,2-8H3,(H,35,36)
C32H50O5514.73643200
73984860

6 of 11 defined stereocentres - 6/11 defined
InChI=1/C32H50O5/c1-18(2)20-11-14-32(27(35)36)16-15-30(7)21(25(20)32)9-10-24-29(6)17-22(34)26(37-19(3)33)28(4,5)23(29)12-13-31(24,30)8/h20-26,34H,1,9-17H2,2-8H3,(H,35,36)/t20?,21?,22-,23?,24?,25?,26+,29+,30-,31-,32+/m1/s1
C32H50O5514.73641100
113609588

11 of 11 defined stereocentres - 11/11 defined
InChI=1/C32H50O5/c1-18(2)20-11-14-32(27(35)36)16-15-30(7)21(25(20)32)9-10-24-29(6)17-22(34)26(37-19(3)33)28(4,5)23(29)12-13-31(24,30)8/h20-26,34H,1,9-17H2,2-8H3,(H,35,36)/t20-,21-,22+,23+,24+,25+,26-,29-,30+,31+,32+/m0/s1
C32H50O5514.73641100
28285801

7 of 11 defined stereocentres - 7/11 defined
InChI=1/C32H50O5/c1-18(2)20-11-14-32(27(35)36)16-15-30(7)21(25(20)32)9-10-24-29(6)17-22(34)26(37-19(3)33)28(4,5)23(29)12-13-31(24,30)8/h20-26,34H,1,9-17H2,2-8H3,(H,35,36)/t20-,21?,22+,23?,24?,25?,26-,29-,30+,31+,32-/m0/s1
C32H50O5514.73641100

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