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 10 results

Search term: YPOMAFCMSAKBRX (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8350315

6 of 12 defined stereocentres - 6/12 defined
InChI=1/C27H30O11/c1-11-19(30)35-17-15(29)25-16-13(28)14(23(2,3)4)24(25)18(34-10-12-8-6-5-7-9-12)20(31)37-22(24)38-27(25,21(32)36-16)26(11,17)33/h5-9,11,13-18,22,28-29,33H,10H2,1-4H3/t11-,13+,14+,15-,16?,17?,18-,22?,24?,25?,26-,27?/m1/s1
C27H30O11530.52052100
8464954

6 of 12 defined stereocentres - 6/12 defined
InChI=1/C27H30O11/c1-11-19(30)35-17-15(29)25-16-13(28)14(23(2,3)4)24(25)18(34-10-12-8-6-5-7-9-12)20(31)37-22(24)38-27(25,21(32)36-16)26(11,17)33/h5-9,11,13-18,22,28-29,33H,10H2,1-4H3/t11-,13-,14+,15-,16?,17?,18-,22?,24?,25?,26-,27?/m1/s1
C27H30O11530.52052100
9267800

12 of 12 defined stereocentres - 12/12 defined
InChI=1/C27H30O11/c1-11-19(30)35-17-15(29)25-16-13(28)14(23(2,3)4)24(25)18(34-10-12-8-6-5-7-9-12)20(31)37-22(24)38-27(25,21(32)36-16)26(11,17)33/h5-9,11,13-18,22,28-29,33H,10H2,1-4H3/t11-,13-,14+,15+,16-,17+,18+,22+,24-,25+,26-,27+/m1/s1
C27H30O11530.52052100
9824178

9 of 12 defined stereocentres - 9/12 defined
InChI=1/C27H30O11/c1-11-19(30)35-17-15(29)25-16-13(28)14(23(2,3)4)24(25)18(34-10-12-8-6-5-7-9-12)20(31)37-22(24)38-27(25,21(32)36-16)26(11,17)33/h5-9,11,13-18,22,28-29,33H,10H2,1-4H3/t11-,13-,14+,15+,16-,17?,18+,22+,24?,25?,26-,27+/m1/s1
C27H30O11530.52052200
9852885

12 of 12 defined stereocentres - 12/12 defined
InChI=1/C27H30O11/c1-11-19(30)35-17-15(29)25-16-13(28)14(23(2,3)4)24(25)18(34-10-12-8-6-5-7-9-12)20(31)37-22(24)38-27(25,21(32)36-16)26(11,17)33/h5-9,11,13-18,22,28-29,33H,10H2,1-4H3/t11-,13-,14+,15+,16-,17-,18+,22+,24+,25-,26-,27+/m1/s1
C27H30O11530.52052100
9988092

12 of 12 defined stereocentres - 12/12 defined
InChI=1/C27H30O11/c1-11-19(30)35-17-15(29)25-16-13(28)14(23(2,3)4)24(25)18(34-10-12-8-6-5-7-9-12)20(31)37-22(24)38-27(25,21(32)36-16)26(11,17)33/h5-9,11,13-18,22,28-29,33H,10H2,1-4H3/t11-,13+,14+,15+,16-,17+,18+,22+,24-,25+,26-,27+/m1/s1
C27H30O11530.52052100
23226926

5 of 12 defined stereocentres - 5/12 defined
InChI=1/C27H30O11/c1-11-19(30)35-17-15(29)25-16-13(28)14(23(2,3)4)24(25)18(34-10-12-8-6-5-7-9-12)20(31)37-22(24)38-27(25,21(32)36-16)26(11,17)33/h5-9,11,13-18,22,28-29,33H,10H2,1-4H3/t11-,13-,14?,15+,16?,17?,18+,22?,24?,25?,26-,27?/m1/s1
C27H30O11530.52052200
23227192

5 of 12 defined stereocentres - 5/12 defined
InChI=1/C27H30O11/c1-11-19(30)35-17-15(29)25-16-13(28)14(23(2,3)4)24(25)18(34-10-12-8-6-5-7-9-12)20(31)37-22(24)38-27(25,21(32)36-16)26(11,17)33/h5-9,11,13-18,22,28-29,33H,10H2,1-4H3/t11-,13+,14?,15+,16?,17?,18+,22?,24?,25?,26-,27?/m1/s1
C27H30O11530.52052200
34980712

4 of 12 defined stereocentres - 4/12 defined
InChI=1/C27H30O11/c1-11-19(30)35-17-15(29)25-16-13(28)14(23(2,3)4)24(25)18(34-10-12-8-6-5-7-9-12)20(31)37-22(24)38-27(25,21(32)36-16)26(11,17)33/h5-9,11,13-18,22,28-29,33H,10H2,1-4H3/t11?,13-,14?,15?,16?,17-,18-,22?,24?,25?,26+,27?/m0/s1
C27H30O11530.52051100
34980714

4 of 12 defined stereocentres - 4/12 defined
InChI=1/C27H30O11/c1-11-19(30)35-17-15(29)25-16-13(28)14(23(2,3)4)24(25)18(34-10-12-8-6-5-7-9-12)20(31)37-22(24)38-27(25,21(32)36-16)26(11,17)33/h5-9,11,13-18,22,28-29,33H,10H2,1-4H3/t11?,13-,14?,15?,16?,17+,18+,22?,24?,25?,26-,27?/m1/s1
C27H30O11530.52051100

Advertisement