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 16 results

Search term: KNEQPJSDSYNUHP (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8168554

Double-bond stereo

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C15H20O4/c1-8-4-5-11(16)9(2)7-13-14(12(17)6-8)10(3)15(18)19-13/h6,11-14,16-17H,2-5,7H2,1H3/b8-6+/t11-,12+,13-,14?/m0/s1
C15H20O4264.31698400
5921622

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C15H20O4/c1-8-4-5-11(16)9(2)7-13-14(12(17)6-8)10(3)15(18)19-13/h6,11-14,16-17H,2-5,7H2,1H3/b8-6+/t11-,12+,13-,14-/m0/s1
C15H20O4264.31697500
81422412

Double-bond stereo

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C15H20O4/c1-8-4-5-11(16)9(2)7-13-14(12(17)6-8)10(3)15(18)19-13/h6,11-14,16-17H,2-5,7H2,1H3/b8-6+/t11-,12-,13+,14?/m1/s1
C15H20O4264.31696500
23256856

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C15H20O4/c1-8-4-5-11(16)9(2)7-13-14(12(17)6-8)10(3)15(18)19-13/h6,11-14,16-17H,2-5,7H2,1H3/b8-6+/t11-,12-,13+,14+/m1/s1
C15H20O4264.31695500
4812638

Double-bond stereo

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C15H20O4/c1-8-4-5-11(16)9(2)7-13-14(12(17)6-8)10(3)15(18)19-13/h6,11-14,16-17H,2-5,7H2,1H3/b8-6+
C15H20O4264.31695500
22875326

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C15H20O4/c1-8-4-5-11(16)9(2)7-13-14(12(17)6-8)10(3)15(18)19-13/h6,11-14,16-17H,2-5,7H2,1H3/b8-6+/t11-,12+,13-,14-/m1/s1
C15H20O4264.31694100
62304813

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C15H20O4/c1-8-4-5-11(16)9(2)7-13-14(12(17)6-8)10(3)15(18)19-13/h6,11-14,16-17H,2-5,7H2,1H3/b8-6-/t11-,12+,13-,14+/m0/s1
C15H20O4264.31693300
4946699

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C15H20O4/c1-8-4-5-11(16)9(2)7-13-14(12(17)6-8)10(3)15(18)19-13/h6,11-14,16-17H,2-5,7H2,1H3/b8-6-/t11-,12-,13+,14+/m1/s1
C15H20O4264.31693300
5442415

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C15H20O4/c1-8-4-5-11(16)9(2)7-13-14(12(17)6-8)10(3)15(18)19-13/h6,11-14,16-17H,2-5,7H2,1H3/t11-,12+,13-,14-/m1/s1
C15H20O4264.31693200
3636834

Double-bond stereo

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C15H20O4/c1-8-4-5-11(16)9(2)7-13-14(12(17)6-8)10(3)15(18)19-13/h6,11-14,16-17H,2-5,7H2,1H3
C15H20O4264.31692100
20136307

Double-bond stereo

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C15H20O4/c1-8-4-5-11(16)9(2)7-13-14(12(17)6-8)10(3)15(18)19-13/h6,11-14,16-17H,2-5,7H2,1H3/b8-6-
C15H20O4264.31692200
5024650

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C15H20O4/c1-8-4-5-11(16)9(2)7-13-14(12(17)6-8)10(3)15(18)19-13/h6,11-14,16-17H,2-5,7H2,1H3/b8-6+/t11-,12+,13-,14+/m0/s1
C15H20O4264.31692100
5326350

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C15H20O4/c1-8-4-5-11(16)9(2)7-13-14(12(17)6-8)10(3)15(18)19-13/h6,11-14,16-17H,2-5,7H2,1H3/b8-6+/t11-,12+,13+,14-/m1/s1
C15H20O4264.31692100
76962744

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C15H20O4/c1-8-4-5-11(16)9(2)7-13-14(12(17)6-8)10(3)15(18)19-13/h6,11-14,16-17H,2-5,7H2,1H3/b8-6-/t11-,12+,13-,14-/m0/s1
C15H20O4264.31691100
114390421

Double-bond stereo

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C15H20O4/c1-8-4-5-11(16)9(2)7-13-14(12(17)6-8)10(3)15(18)19-13/h6,11-14,16-17H,2-5,7H2,1H3/b8-6+/t11?,12-,13+,14?/m1/s1
C15H20O4264.31691100

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