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 3 results

Search term: IYDNDHPDBKEZBK (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
17462646

Double-bond stereo

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C31H47NO4/c1-3-4-7-10-26(33)19-15-23-18-22-29(34)28(23)11-8-5-6-9-12-30(35)32-31(24-13-14-24)25-16-20-27(36-2)21-17-25/h15-17,19-21,23-24,26,28,31,33H,3-14,18,22H2,1-2H3,(H,32,35)/b19-15+/t23-,26-,28+,31?/m0/s1
C31H47NO4497.709211900
3574279

Double-bond stereo

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C31H47NO4/c1-3-4-7-10-26(33)19-15-23-18-22-29(34)28(23)11-8-5-6-9-12-30(35)32-31(24-13-14-24)25-16-20-27(36-2)21-17-25/h15-17,19-21,23-24,26,28,31,33H,3-14,18,22H2,1-2H3,(H,32,35)
C31H47NO4497.7091800000012100
62232482

Double-bond stereo

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C31H47NO4/c1-3-4-7-10-26(33)19-15-23-18-22-29(34)28(23)11-8-5-6-9-12-30(35)32-31(24-13-14-24)25-16-20-27(36-2)21-17-25/h15-17,19-21,23-24,26,28,31,33H,3-14,18,22H2,1-2H3,(H,32,35)/t23-,26-,28+,31?/m0/s1
C31H47NO4497.70921100

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