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 19 results

Search term: WVHKCBDRQIXZLC (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
220418

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C22H32O4/c1-13(23)26-15-8-10-21(2)14(12-15)4-5-16-17-6-7-19(20(24)25)22(17,3)11-9-18(16)21/h4,15-19H,5-12H2,1-3H3,(H,24,25)/t15-,16-,17-,18-,19+,21-,22-/m0/s1
C22H32O4360.4871251800
467191

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C22H32O4/c1-13(23)26-15-8-10-21(2)14(12-15)4-5-16-17-6-7-19(20(24)25)22(17,3)11-9-18(16)21/h4,15-19H,5-12H2,1-3H3,(H,24,25)
C22H32O4360.487114700
4954868

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C22H32O4/c1-13(23)26-15-8-10-21(2)14(12-15)4-5-16-17-6-7-19(20(24)25)22(17,3)11-9-18(16)21/h4,15-19H,5-12H2,1-3H3,(H,24,25)/t15-,16-,17-,18-,19?,21-,22-/m0/s1
C22H32O4360.487113900
12555009

3 of 7 defined stereocentres - 3/7 defined
InChI=1/C22H32O4/c1-13(23)26-15-8-10-21(2)14(12-15)4-5-16-17-6-7-19(20(24)25)22(17,3)11-9-18(16)21/h4,15-19H,5-12H2,1-3H3,(H,24,25)/t15-,16?,17?,18?,19?,21-,22-/m0/s1
C22H32O4360.48716100
10042481

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C22H32O4/c1-13(23)26-15-8-10-21(2)14(12-15)4-5-16-17-6-7-19(20(24)25)22(17,3)11-9-18(16)21/h4,15-19H,5-12H2,1-3H3,(H,24,25)/t15-,16-,17+,18+,19+,21+,22+/m0/s1
C22H32O4360.48712100
10042477

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C22H32O4/c1-13(23)26-15-8-10-21(2)14(12-15)4-5-16-17-6-7-19(20(24)25)22(17,3)11-9-18(16)21/h4,15-19H,5-12H2,1-3H3,(H,24,25)/t15-,16-,17+,18+,19+,21-,22+/m0/s1
C22H32O4360.48712100
10042479

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C22H32O4/c1-13(23)26-15-8-10-21(2)14(12-15)4-5-16-17-6-7-19(20(24)25)22(17,3)11-9-18(16)21/h4,15-19H,5-12H2,1-3H3,(H,24,25)/t15-,16+,17-,18-,19-,21-,22-/m1/s1
C22H32O4360.48712100
10042475

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C22H32O4/c1-13(23)26-15-8-10-21(2)14(12-15)4-5-16-17-6-7-19(20(24)25)22(17,3)11-9-18(16)21/h4,15-19H,5-12H2,1-3H3,(H,24,25)/t15-,16+,17-,18-,19-,21+,22-/m1/s1
C22H32O4360.48712100
1267602

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C22H32O4/c1-13(23)26-15-8-10-21(2)14(12-15)4-5-16-17-6-7-19(20(24)25)22(17,3)11-9-18(16)21/h4,15-19H,5-12H2,1-3H3,(H,24,25)/t15-,16-,17+,18-,19+,21-,22+/m1/s1
C22H32O4360.48712100
2744479

Charge

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C22H32O4/c1-13(23)26-15-8-10-21(2)14(12-15)4-5-16-17-6-7-19(20(24)25)22(17,3)11-9-18(16)21/h4,15-19H,5-12H2,1-3H3,(H,24,25)/p-1
C22H31O4359.479141100
1267601

Charge

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C22H32O4/c1-13(23)26-15-8-10-21(2)14(12-15)4-5-16-17-6-7-19(20(24)25)22(17,3)11-9-18(16)21/h4,15-19H,5-12H2,1-3H3,(H,24,25)/p-1/t15-,16-,17+,18-,19+,21-,22+/m1/s1
C22H31O4359.47971100
10042476

Charge

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C22H32O4/c1-13(23)26-15-8-10-21(2)14(12-15)4-5-16-17-6-7-19(20(24)25)22(17,3)11-9-18(16)21/h4,15-19H,5-12H2,1-3H3,(H,24,25)/p-1/t15-,16-,17+,18+,19+,21-,22+/m0/s1
C22H31O4359.47971100
10042474

Charge

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C22H32O4/c1-13(23)26-15-8-10-21(2)14(12-15)4-5-16-17-6-7-19(20(24)25)22(17,3)11-9-18(16)21/h4,15-19H,5-12H2,1-3H3,(H,24,25)/p-1/t15-,16+,17-,18-,19-,21+,22-/m1/s1
C22H31O4359.47971100
10042480

Charge

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C22H32O4/c1-13(23)26-15-8-10-21(2)14(12-15)4-5-16-17-6-7-19(20(24)25)22(17,3)11-9-18(16)21/h4,15-19H,5-12H2,1-3H3,(H,24,25)/p-1/t15-,16-,17+,18+,19+,21+,22+/m0/s1
C22H31O4359.47971100
10042478

Charge

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C22H32O4/c1-13(23)26-15-8-10-21(2)14(12-15)4-5-16-17-6-7-19(20(24)25)22(17,3)11-9-18(16)21/h4,15-19H,5-12H2,1-3H3,(H,24,25)/p-1/t15-,16+,17-,18-,19-,21-,22-/m1/s1
C22H31O4359.47971100
10050758

Charge

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C22H32O4/c1-13(23)26-15-8-10-21(2)14(12-15)4-5-16-17-6-7-19(20(24)25)22(17,3)11-9-18(16)21/h4,15-19H,5-12H2,1-3H3,(H,24,25)/p-1/t15-,16-,17-,18-,19+,21-,22-/m0/s1
C22H31O4359.47971100
74090173

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C22H32O4/c1-13(23)26-15-8-10-21(2)14(12-15)4-5-16-17-6-7-19(20(24)25)22(17,3)11-9-18(16)21/h4,15-19H,5-12H2,1-3H3,(H,24,25)/t15?,16-,17-,18-,19+,21-,22-/m0/s1
C22H32O4360.48711100

Advertisement