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
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Found 2 results

Search term: NWKFSSXQDSMIPF (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
9608297

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C37H64O6/c1-3-4-5-6-7-13-16-19-22-31(38)33-24-26-35(42-33)36-27-25-34(43-36)32(39)23-20-17-14-11-9-8-10-12-15-18-21-30-28-29(2)41-37(30)40/h15,18,28-29,31-36,38-39H,3-14,16-17,19-27H2,1-2H3/b18-15+/t29-,31-,32+,33+,34+,35-,36-/m0/s1
C37H64O6604.90053200
30788465

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C37H64O6/c1-3-4-5-6-7-13-16-19-22-31(38)33-24-26-35(42-33)36-27-25-34(43-36)32(39)23-20-17-14-11-9-8-10-12-15-18-21-30-28-29(2)41-37(30)40/h15,18,28-29,31-36,38-39H,3-14,16-17,19-27H2,1-2H3/b18-15+/t29-,31+,32+,33-,34+,35-,36-/m0/s1
C37H64O6604.90051100

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