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 4 results

Search term: GOOGBJQGXFURHE (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8706843

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C33H48O9/c1-20(9-14-27(34)31(2,3)40-19-37-6)24-12-13-25-23-11-10-21-17-22(41-29(35)38-7)18-28(42-30(36)39-8)33(21,5)26(23)15-16-32(24,25)4/h9-11,14,20,22,24-26,28H,12-13,15-19H2,1-8H3/b14-9+/t20-,22+,24+,25-,26-,28-,32+,33-/m0/s1
C33H48O9588.72882100
8873951

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C33H48O9/c1-20(9-14-27(34)31(2,3)40-19-37-6)24-12-13-25-23-11-10-21-17-22(41-29(35)38-7)18-28(42-30(36)39-8)33(21,5)26(23)15-16-32(24,25)4/h9-11,14,20,22,24-26,28H,12-13,15-19H2,1-8H3/b14-9-/t20-,22+,24+,25-,26-,28-,32+,33-/m0/s1
C33H48O9588.72882100
9050911

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C33H48O9/c1-20(9-14-27(34)31(2,3)40-19-37-6)24-12-13-25-23-11-10-21-17-22(41-29(35)38-7)18-28(42-30(36)39-8)33(21,5)26(23)15-16-32(24,25)4/h9-11,14,20,22,24-26,28H,12-13,15-19H2,1-8H3/b14-9-/t20-,22-,24-,25+,26+,28+,32-,33+/m1/s1
C33H48O9588.72882100
9988617

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C33H48O9/c1-20(9-14-27(34)31(2,3)40-19-37-6)24-12-13-25-23-11-10-21-17-22(41-29(35)38-7)18-28(42-30(36)39-8)33(21,5)26(23)15-16-32(24,25)4/h9-11,14,20,22,24-26,28H,12-13,15-19H2,1-8H3/b14-9+/t20-,22-,24-,25+,26+,28+,32-,33+/m1/s1
C33H48O9588.72882100

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