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: UNBMQQNYLCPCHS (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4941432

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C21H36O4/c1-8-13(4)18(22)16(7)19(23)14(5)10-12(3)11-15(6)20-17(9-2)21(24)25-20/h10,13-18,20,22H,8-9,11H2,1-7H3/b12-10+/t13-,14-,15+,16+,17+,18-,20+/m1/s1
C21H36O4352.5081181000
4712018

Double-bond stereo

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C21H36O4/c1-8-13(4)18(22)16(7)19(23)14(5)10-12(3)11-15(6)20-17(9-2)21(24)25-20/h10,13-18,20,22H,8-9,11H2,1-7H3/b12-10+
C21H36O4352.508110800
3081

Double-bond stereo

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C21H36O4/c1-8-13(4)18(22)16(7)19(23)14(5)10-12(3)11-15(6)20-17(9-2)21(24)25-20/h10,13-18,20,22H,8-9,11H2,1-7H3
C21H36O4352.50813200
8264921

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C21H36O4/c1-8-13(4)18(22)16(7)19(23)14(5)10-12(3)11-15(6)20-17(9-2)21(24)25-20/h10,13-18,20,22H,8-9,11H2,1-7H3/b12-10+/t13-,14+,15-,16-,17-,18+,20-/m0/s1
C21H36O4352.50812100
59700965

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C21H36O4/c1-8-13(4)18(22)16(7)19(23)14(5)10-12(3)11-15(6)20-17(9-2)21(24)25-20/h10,13-18,20,22H,8-9,11H2,1-7H3/b12-10+/t13-,14-,15+,16+,17+,18-,20-/m1/s1
C21H36O4352.50812100
65321601

Double-bond stereo

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C21H36O4/c1-8-13(4)18(22)16(7)19(23)14(5)10-12(3)11-15(6)20-17(9-2)21(24)25-20/h10,13-18,20,22H,8-9,11H2,1-7H3/t13-,14-,15+,16+,17+,18-,20?/m1/s1
C21H36O4352.50811100
58164337

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C21H36O4/c1-8-13(4)18(22)16(7)19(23)14(5)10-12(3)11-15(6)20-17(9-2)21(24)25-20/h10,13-18,20,22H,8-9,11H2,1-7H3/t13-,14-,15+,16+,17+,18-,20-/m1/s1
C21H36O4352.50811100

Advertisement