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: WHQXCEHFHHKCDK (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8434131

18 of 19 defined stereocentres - 18/19 defined
InChI=1/C25H43NO18/c1-6-11(14(32)19(37)24(40-6)44-22-10(5-29)41-23(39)18(36)17(22)35)26-8-2-7(3-27)21(16(34)12(8)30)43-25-20(38)15(33)13(31)9(4-28)42-25/h2,6,8-39H,3-5H2,1H3/t6-,8+,9-,10-,11-,12+,13-,14+,15+,16-,17-,18-,19-,20-,21-,22-,23?,24-,25-/m1/s1
C25H43NO18645.60482100
4450593

19 of 19 defined stereocentres - 19/19 defined
InChI=1/C25H43NO18/c1-6-11(14(32)19(37)24(40-6)44-22-10(5-29)41-23(39)18(36)17(22)35)26-8-2-7(3-27)21(16(34)12(8)30)43-25-20(38)15(33)13(31)9(4-28)42-25/h2,6,8-39H,3-5H2,1H3/t6-,8+,9-,10-,11-,12+,13-,14+,15+,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-/m1/s1
C25H43NO18645.6048199999991100
4450594

19 of 19 defined stereocentres - 19/19 defined
InChI=1/C25H43NO18/c1-6-11(14(32)19(37)24(40-6)44-22-10(5-29)41-23(39)18(36)17(22)35)26-8-2-7(3-27)21(16(34)12(8)30)43-25-20(38)15(33)13(31)9(4-28)42-25/h2,6,8-39H,3-5H2,1H3/t6-,8+,9-,10-,11-,12+,13-,14+,15+,16-,17-,18-,19-,20-,21-,22-,23+,24-,25-/m1/s1
C25H43NO18645.6048199999991100

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