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 2 results

Search term: BGWJMSIHZCMOFC (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
24766062

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C45H82O5/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-26-28-30-32-34-36-38-40-45(48)50-43(41-46)42-49-44(47)39-37-35-33-31-29-27-25-18-16-14-12-10-8-6-4-2/h6,8,12,14,18,25,43,46H,3-5,7,9-11,13,15-17,19-24,26-42H2,1-2H3/b8-6-,14-12-,25-18-/t43-/m0/s1
C45H82O5703.12965500
59697473

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C45H82O5/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-26-28-30-32-34-36-38-40-45(48)50-43(41-46)42-49-44(47)39-37-35-33-31-29-27-25-18-16-14-12-10-8-6-4-2/h6,8,12,14,18,25,43,46H,3-5,7,9-11,13,15-17,19-24,26-42H2,1-2H3/b8-6+,14-12+,25-18+/t43-/m0/s1
C45H82O5703.12961100

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