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
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Found 7 results

Search term: XFWZBMTTXLUWKW (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
266846

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C17H20O5/c1-16-5-4-6-17(2)13(16)11(21-15(17)19)7-9-10(16)8-12(18)22-14(9)20-3/h7-8,11,13-14H,4-6H2,1-3H3/t11-,13-,14+,16-,17+/m1/s1
C17H20O5304.3377181500
90079

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C17H20O5/c1-16-5-4-6-17(2)13(16)11(21-15(17)19)7-9-10(16)8-12(18)22-14(9)20-3/h7-8,11,13-14H,4-6H2,1-3H3
C17H20O5304.33775300
9121873

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C17H20O5/c1-16-5-4-6-17(2)13(16)11(21-15(17)19)7-9-10(16)8-12(18)22-14(9)20-3/h7-8,11,13-14H,4-6H2,1-3H3/t11-,13-,14-,16-,17+/m1/s1
C17H20O5304.33774300
9897275

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C17H20O5/c1-16-5-4-6-17(2)13(16)11(21-15(17)19)7-9-10(16)8-12(18)22-14(9)20-3/h7-8,11,13-14H,4-6H2,1-3H3/t11-,13?,14-,16-,17+/m1/s1
C17H20O5304.33772100
438205

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C17H20O5/c1-16-5-4-6-17(2)13(16)11(21-15(17)19)7-9-10(16)8-12(18)22-14(9)20-3/h7-8,11,13-14H,4-6H2,1-3H3/t11?,13-,14+,16-,17+/m1/s1
C17H20O5304.33772200
8600552

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C17H20O5/c1-16-5-4-6-17(2)13(16)11(21-15(17)19)7-9-10(16)8-12(18)22-14(9)20-3/h7-8,11,13-14H,4-6H2,1-3H3/t11-,13?,14+,16-,17+/m1/s1
C17H20O5304.33772100
58816854

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C17H20O5/c1-16-5-4-6-17(2)13(16)11(21-15(17)19)7-9-10(16)8-12(18)22-14(9)20-3/h7-8,11,13-14H,4-6H2,1-3H3/t11-,13-,14+,16?,17+/m1/s1
C17H20O5304.33771100

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