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: MTOWHSWHTBFYKC (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
21346472

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C33H43N3O6/c1-22(2)19-26(29(38)39)34-30(40)33(25-13-7-6-8-14-25)15-17-35(18-16-33)28(37)27-20-23-11-9-10-12-24(23)21-36(27)31(41)42-32(3,4)5/h6-14,22,26-27H,15-21H2,1-5H3,(H,34,40)(H,38,39)/t26-,27-/m0/s1
C33H43N3O6577.71111800
21344937

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C33H43N3O6/c1-22(2)19-26(29(38)39)34-30(40)33(25-13-7-6-8-14-25)15-17-35(18-16-33)28(37)27-20-23-11-9-10-12-24(23)21-36(27)31(41)42-32(3,4)5/h6-14,22,26-27H,15-21H2,1-5H3,(H,34,40)(H,38,39)/t26-,27-/m1/s1
C33H43N3O6577.7118700
68075256

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C33H43N3O6/c1-22(2)19-26(29(38)39)34-30(40)33(25-13-7-6-8-14-25)15-17-35(18-16-33)28(37)27-20-23-11-9-10-12-24(23)21-36(27)31(41)42-32(3,4)5/h6-14,22,26-27H,15-21H2,1-5H3,(H,34,40)(H,38,39)
C33H43N3O6577.7111100

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