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: YIWFJLGLYGKPCC (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
9309202

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C25H34O7/c1-5-6-7-8-9-10-11-19-16-21-20(14-15-25(19,24(21)29)32-18(3)27)22(31-17(2)26)12-13-23(28)30-4/h9-10,14-16,20-22H,5-8,11-13H2,1-4H3/b10-9-/t20-,21+,22+,25-/m0/s1
C25H34O7446.53334300
10156467

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C25H34O7/c1-5-6-7-8-9-10-11-19-16-21-20(14-15-25(19,24(21)29)32-18(3)27)22(31-17(2)26)12-13-23(28)30-4/h9-10,14-16,20-22H,5-8,11-13H2,1-4H3/b10-9-/t20-,21-,22+,25+/m1/s1
C25H34O7446.53332100
10195717

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C25H34O7/c1-5-6-7-8-9-10-11-19-16-21-20(14-15-25(19,24(21)29)32-18(3)27)22(31-17(2)26)12-13-23(28)30-4/h9-10,14-16,20-22H,5-8,11-13H2,1-4H3/b10-9-/t20-,21-,22-,25+/m1/s1
C25H34O7446.53332223
28283721

Double-bond stereo

1 of 4 defined stereocentres - 1/4 defined
InChI=1/C25H34O7/c1-5-6-7-8-9-10-11-19-16-21-20(14-15-25(19,24(21)29)32-18(3)27)22(31-17(2)26)12-13-23(28)30-4/h9-10,14-16,20-22H,5-8,11-13H2,1-4H3/b10-9-/t20?,21?,22-,25?/m1/s1
C25H34O7446.53331100

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