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 8 results

Search term: DDLLIYKVDWPHJI (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
305173

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C15H20O4/c1-8-10-9(6-13(2,7-16)12(10)18)11(17)14(3,19)15(8)4-5-15/h6,12,16,18-19H,4-5,7H2,1-3H3/t12-,13+,14+/m1/s1
C15H20O4264.3169505274
91347

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C15H20O4/c1-8-10-9(6-13(2,7-16)12(10)18)11(17)14(3,19)15(8)4-5-15/h6,12,16,18-19H,4-5,7H2,1-3H3
C15H20O4264.3169121000
30811400

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C15H20O4/c1-8-10-9(6-13(2,7-16)12(10)18)11(17)14(3,19)15(8)4-5-15/h6,12,16,18-19H,4-5,7H2,1-3H3/t12?,13-,14-/m1/s1
C15H20O4264.31693300
58919318

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C15H20O4/c1-8-10-9(6-13(2,7-16)12(10)18)11(17)14(3,19)15(8)4-5-15/h6,12,16,18-19H,4-5,7H2,1-3H3/t12-,13+,14-/m1/s1
C15H20O4264.31693300
8168550

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C15H20O4/c1-8-10-9(6-13(2,7-16)12(10)18)11(17)14(3,19)15(8)4-5-15/h6,12,16,18-19H,4-5,7H2,1-3H3/t12-,13+,14+/m0/s1
C15H20O4264.31692100
8978910

3 of 3 defined stereocentres - 3/3 defined

Non-standard isotope
InChI=1/C15H20O4/c1-8-10-9(6-13(2,7-16)12(10)18)11(17)14(3,19)15(8)4-5-15/h6,12,16,18-19H,4-5,7H2,1-3H3/t12-,13+,14+/m1/s1/i1T3,2T3,3T3,4T2,6T,7T2/t12-,13+,14+,15?
C15H6T14O4292.43042200
23202080

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C15H20O4/c1-8-10-9(6-13(2,7-16)12(10)18)11(17)14(3,19)15(8)4-5-15/h6,12,16,18-19H,4-5,7H2,1-3H3/t12?,13-,14-/m0/s1
C15H20O4264.31692200
110803778

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C15H20O4/c1-8-10-9(6-13(2,7-16)12(10)18)11(17)14(3,19)15(8)4-5-15/h6,12,16,18-19H,4-5,7H2,1-3H3/t12-,13-,14-/m1/s1
C15H20O4264.31691100

Advertisement