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 4 results

Search term: KEMCGGSAAWVSIG (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
117306

11 of 11 defined stereocentres - 11/11 defined
InChI=1/C26H46N2O4/c1-15(4-7-23(32)28-11-10-27)18-5-6-19-24-20(14-22(31)26(18,19)3)25(2)9-8-17(29)12-16(25)13-21(24)30/h15-22,24,29-31H,4-14,27H2,1-3H3,(H,28,32)/t15-,16+,17-,18+,19+,20+,21-,22+,24+,25+,26-/m1/s1
C26H46N2O4450.65444400
9158445

10 of 11 defined stereocentres - 10/11 defined
InChI=1/C26H46N2O4/c1-15(4-7-23(32)28-11-10-27)18-5-6-19-24-20(14-22(31)26(18,19)3)25(2)9-8-17(29)12-16(25)13-21(24)30/h15-22,24,29-31H,4-14,27H2,1-3H3,(H,28,32)/t15-,16?,17-,18-,19+,20+,21-,22+,24+,25+,26-/m1/s1
C26H46N2O4450.65442100
10122989

6 of 11 defined stereocentres - 6/11 defined
InChI=1/C26H46N2O4/c1-15(4-7-23(32)28-11-10-27)18-5-6-19-24-20(14-22(31)26(18,19)3)25(2)9-8-17(29)12-16(25)13-21(24)30/h15-22,24,29-31H,4-14,27H2,1-3H3,(H,28,32)/t15?,16?,17-,18-,19?,20?,21-,22+,24?,25+,26-/m1/s1
C26H46N2O4450.65442100

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