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: SLLLSIAIIFCYHO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
108926

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C30H27N3O6/c1-4-11-37-15-9-10-20-17(12-15)24-25-18(14-31-28(25)34)23-16-7-5-6-8-21(16)33-27(23)26(24)32(20)22-13-19(29(35)39-36-3)30(33,2)38-22/h5-10,12,19,22H,4,11,13-14H2,1-3H3,(H,31,34)/t19-,22+,30-/m0/s1
C30H27N3O6525.5519101000
95640616

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C30H27N3O6/c1-4-11-37-15-9-10-20-17(12-15)24-25-18(14-31-28(25)34)23-16-7-5-6-8-21(16)33-27(23)26(24)32(20)22-13-19(29(35)39-36-3)30(33,2)38-22/h5-10,12,19,22H,4,11,13-14H2,1-3H3,(H,31,34)
C30H27N3O6525.55192200
58816605

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C30H27N3O6/c1-4-11-37-15-9-10-20-17(12-15)24-25-18(14-31-28(25)34)23-16-7-5-6-8-21(16)33-27(23)26(24)32(20)22-13-19(29(35)39-36-3)30(33,2)38-22/h5-10,12,19,22H,4,11,13-14H2,1-3H3,(H,31,34)/t19-,22?,30-/m0/s1
C30H27N3O6525.55191100

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