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: AAVQKUIYEDNBDS (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
414776

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C32H45N3O7/c1-7-21(2)28(29(38)33-25(30(39)41-6)19-23-16-12-9-13-17-23)35-27(37)20-26(36)24(18-22-14-10-8-11-15-22)34-31(40)42-32(3,4)5/h8-17,21,24-26,28,36H,7,18-20H2,1-6H3,(H,33,38)(H,34,40)(H,35,37)/t21-,24-,25-,26-,28-/m0/s1
C32H45N3O7583.71564300
414781

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C32H45N3O7/c1-7-21(2)28(29(38)33-25(30(39)41-6)19-23-16-12-9-13-17-23)35-27(37)20-26(36)24(18-22-14-10-8-11-15-22)34-31(40)42-32(3,4)5/h8-17,21,24-26,28,36H,7,18-20H2,1-6H3,(H,33,38)(H,34,40)(H,35,37)/t21?,24-,25+,26-,28+/m0/s1
C32H45N3O7583.71562200
8850153

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C32H45N3O7/c1-7-21(2)28(29(38)33-25(30(39)41-6)19-23-16-12-9-13-17-23)35-27(37)20-26(36)24(18-22-14-10-8-11-15-22)34-31(40)42-32(3,4)5/h8-17,21,24-26,28,36H,7,18-20H2,1-6H3,(H,33,38)(H,34,40)(H,35,37)/t21-,24+,25-,26+,28-/m1/s1
C32H45N3O7583.71562100

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