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: OOYFLPWTUQXPSY (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
28525993

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C35H50N6O7S/c1-7-35(5,6)48-21(4)28-32(46)36-23(16-20(2)3)29(43)38-25(18-42)34(47)41-15-11-14-27(41)31(45)37-24(17-22-12-9-8-10-13-22)33-39-26(19-49-33)30(44)40-28/h7-10,12-13,20-21,23-28,42H,1,11,14-19H2,2-6H3,(H,36,46)(H,37,45)(H,38,43)(H,40,44)/t21-,23+,24-,25+,26-,27+,28+/m1/s1
C35H50N6O7S698.87252200
34530047

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C35H50N6O7S/c1-7-35(5,6)48-21(4)28-32(46)36-23(16-20(2)3)29(43)38-25(18-42)34(47)41-15-11-14-27(41)31(45)37-24(17-22-12-9-8-10-13-22)33-39-26(19-49-33)30(44)40-28/h7-10,12-13,20-21,23-28,42H,1,11,14-19H2,2-6H3,(H,36,46)(H,37,45)(H,38,43)(H,40,44)/t21-,23?,24-,25+,26-,27+,28+/m1/s1
C35H50N6O7S698.87251100

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