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 5 results

Search term: DQYHJNRIHHTMIO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
17469648

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C28H32N4O6/c1-17(2)15-21(27(36)37)29-24(33)22-13-8-14-31(22)26(35)23(16-18-9-4-3-5-10-18)32-25(34)19-11-6-7-12-20(19)30-28(32)38/h3-7,9-12,17,21-23H,8,13-16H2,1-2H3,(H,29,33)(H,30,38)(H,36,37)/t21-,22-,23-/m0/s1
C28H32N4O6520.5769131100
17469169

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C28H32N4O6/c1-17(2)15-21(27(36)37)29-24(33)22-13-8-14-31(22)26(35)23(16-18-9-4-3-5-10-18)32-25(34)19-11-6-7-12-20(19)30-28(32)38/h3-7,9-12,17,21-23H,8,13-16H2,1-2H3,(H,29,33)(H,30,38)(H,36,37)/t21-,22+,23+/m1/s1
C28H32N4O6520.576910700
4023998

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C28H32N4O6/c1-17(2)15-21(27(36)37)29-24(33)22-13-8-14-31(22)26(35)23(16-18-9-4-3-5-10-18)32-25(34)19-11-6-7-12-20(19)30-28(32)38/h3-7,9-12,17,21-23H,8,13-16H2,1-2H3,(H,29,33)(H,30,38)(H,36,37)
C28H32N4O6520.576882100

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