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 13 results

Search term: XFNYGKWBCJHCQE (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
17465152

2 of 7 defined stereocentres - 2/7 defined
InChI=1/C23H34O5/c1-22-11-9-15(24)13-14(22)3-4-16-17-5-6-19(23(17,2)12-10-18(16)22)28-21(27)8-7-20(25)26/h14,16-19H,3-13H2,1-2H3,(H,25,26)/t14?,16?,17?,18?,19?,22-,23-/m0/s1
C23H34O5390.51315200
10049736

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C23H34O5/c1-22-11-9-15(24)13-14(22)3-4-16-17-5-6-19(23(17,2)12-10-18(16)22)28-21(27)8-7-20(25)26/h14,16-19H,3-13H2,1-2H3,(H,25,26)/t14-,16+,17+,18-,19-,22-,23-/m0/s1
C23H34O5390.51312100
10049738

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C23H34O5/c1-22-11-9-15(24)13-14(22)3-4-16-17-5-6-19(23(17,2)12-10-18(16)22)28-21(27)8-7-20(25)26/h14,16-19H,3-13H2,1-2H3,(H,25,26)/t14-,16-,17-,18+,19+,22+,23+/m1/s1
C23H34O5390.51312100
1389268

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C23H34O5/c1-22-11-9-15(24)13-14(22)3-4-16-17-5-6-19(23(17,2)12-10-18(16)22)28-21(27)8-7-20(25)26/h14,16-19H,3-13H2,1-2H3,(H,25,26)/t14-,16-,17+,18+,19-,22+,23-/m0/s1
C23H34O5390.51312100
2936301

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C23H34O5/c1-22-11-9-15(24)13-14(22)3-4-16-17-5-6-19(23(17,2)12-10-18(16)22)28-21(27)8-7-20(25)26/h14,16-19H,3-13H2,1-2H3,(H,25,26)
C23H34O5390.513062100
10049732

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C23H34O5/c1-22-11-9-15(24)13-14(22)3-4-16-17-5-6-19(23(17,2)12-10-18(16)22)28-21(27)8-7-20(25)26/h14,16-19H,3-13H2,1-2H3,(H,25,26)/t14-,16-,17+,18-,19-,22-,23-/m0/s1
C23H34O5390.51312100
10049734

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C23H34O5/c1-22-11-9-15(24)13-14(22)3-4-16-17-5-6-19(23(17,2)12-10-18(16)22)28-21(27)8-7-20(25)26/h14,16-19H,3-13H2,1-2H3,(H,25,26)/t14-,16+,17-,18+,19+,22+,23+/m1/s1
C23H34O5390.51312100
10049735

Charge

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C23H34O5/c1-22-11-9-15(24)13-14(22)3-4-16-17-5-6-19(23(17,2)12-10-18(16)22)28-21(27)8-7-20(25)26/h14,16-19H,3-13H2,1-2H3,(H,25,26)/p-1/t14-,16+,17+,18-,19-,22-,23-/m0/s1
C23H33O5389.50571100
10049733

Charge

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C23H34O5/c1-22-11-9-15(24)13-14(22)3-4-16-17-5-6-19(23(17,2)12-10-18(16)22)28-21(27)8-7-20(25)26/h14,16-19H,3-13H2,1-2H3,(H,25,26)/p-1/t14-,16+,17-,18+,19+,22+,23+/m1/s1
C23H33O5389.50571100
8268641

4 of 7 defined stereocentres - 4/7 defined
InChI=1/C23H34O5/c1-22-11-9-15(24)13-14(22)3-4-16-17-5-6-19(23(17,2)12-10-18(16)22)28-21(27)8-7-20(25)26/h14,16-19H,3-13H2,1-2H3,(H,25,26)/t14-,16?,17?,18?,19+,22+,23+/m1/s1
C23H34O5390.51311100
10049731

Charge

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C23H34O5/c1-22-11-9-15(24)13-14(22)3-4-16-17-5-6-19(23(17,2)12-10-18(16)22)28-21(27)8-7-20(25)26/h14,16-19H,3-13H2,1-2H3,(H,25,26)/p-1/t14-,16-,17+,18-,19-,22-,23-/m0/s1
C23H33O5389.50571100
1389267

Charge

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C23H34O5/c1-22-11-9-15(24)13-14(22)3-4-16-17-5-6-19(23(17,2)12-10-18(16)22)28-21(27)8-7-20(25)26/h14,16-19H,3-13H2,1-2H3,(H,25,26)/p-1/t14-,16-,17+,18+,19-,22+,23-/m0/s1
C23H33O5389.50571100
10049737

Charge

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C23H34O5/c1-22-11-9-15(24)13-14(22)3-4-16-17-5-6-19(23(17,2)12-10-18(16)22)28-21(27)8-7-20(25)26/h14,16-19H,3-13H2,1-2H3,(H,25,26)/p-1/t14-,16-,17-,18+,19+,22+,23+/m1/s1
C23H33O5389.50571100

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