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
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Single/Multi-component
Isotopically Labeled
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Found 2 results

Search term: BVUAPFPPYOQLKK (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
24844875

5 of 10 defined stereocentres - 5/10 defined
InChI=1/C30H32O19/c1-9-20(37)23(40)25(42)29(45-9)46-11-5-14(33)19-15(6-11)47-27(10-2-3-12(31)13(32)4-10)28(22(19)39)49-30-26(43)24(41)21(38)16(48-30)8-44-18(36)7-17(34)35/h2-6,9,16,20-21,23-26,29-33,37-38,40-43H,7-8H2,1H3,(H,34,35)/t9?,16?,20-,21+,23-,24?,25?,26?,29-,30-/m0/s1
C30H32O19696.56371100
115270053

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C30H32O19/c1-9-20(37)23(40)25(42)29(45-9)46-11-5-14(33)19-15(6-11)47-27(10-2-3-12(31)13(32)4-10)28(22(19)39)49-30-26(43)24(41)21(38)16(48-30)8-44-18(36)7-17(34)35/h2-6,9,16,20-21,23-26,29-33,37-38,40-43H,7-8H2,1H3,(H,34,35)/t9-,16+,20-,21+,23+,24-,25+,26+,29-,30-/m0/s1
C30H32O19696.56371100

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