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 7 results

Search term: QPFFEVMIQIJTGZ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4977577

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C20H24O7/c1-12(15(21)22)4-3-8-18(2)14-7-10-19(17(25)27-18)9-5-13(16(23)24)6-11-20(14,19)26/h3-5,8,14,26H,6-7,9-11H2,1-2H3,(H,21,22)(H,23,24)/b8-3+,12-4+/t14-,18+,19+,20-/m0/s1
C20H24O7376.4004252200
57576974

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C20H24O7/c1-12(15(21)22)4-3-8-18(2)14-7-10-19(17(25)27-18)9-5-13(16(23)24)6-11-20(14,19)26/h3-5,8,14,26H,6-7,9-11H2,1-2H3,(H,21,22)(H,23,24)/b8-3u,12-4+/t14-,18+,19+,20-/m0/s1
C20H24O7376.40042200
82965795

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C20H24O7/c1-12(15(21)22)4-3-8-18(2)14-7-10-19(17(25)27-18)9-5-13(16(23)24)6-11-20(14,19)26/h3-5,8,14,26H,6-7,9-11H2,1-2H3,(H,21,22)(H,23,24)/b8-3+,12-4+/t14-,18+,19+,20-/m1/s1
C20H24O7376.40042100
95532284

Double-bond stereo

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C20H24O7/c1-12(15(21)22)4-3-8-18(2)14-7-10-19(17(25)27-18)9-5-13(16(23)24)6-11-20(14,19)26/h3-5,8,14,26H,6-7,9-11H2,1-2H3,(H,21,22)(H,23,24)/b8-3+,12-4+/t14?,18-,19-,20+/m1/s1
C20H24O7376.40041100
101936468

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C20H24O7/c1-12(15(21)22)4-3-8-18(2)14-7-10-19(17(25)27-18)9-5-13(16(23)24)6-11-20(14,19)26/h3-5,8,14,26H,6-7,9-11H2,1-2H3,(H,21,22)(H,23,24)/b8-3+,12-4u/t14-,18+,19+,20-/m0/s1
C20H24O7376.40041200
113610947

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C20H24O7/c1-12(15(21)22)4-3-8-18(2)14-7-10-19(17(25)27-18)9-5-13(16(23)24)6-11-20(14,19)26/h3-5,8,14,26H,6-7,9-11H2,1-2H3,(H,21,22)(H,23,24)/b8-3+,12-4u/t14-,18-,19-,20-/m1/s1
C20H24O7376.40041100
129310531

Double-bond stereo

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C20H24O7/c1-12(15(21)22)4-3-8-18(2)14-7-10-19(17(25)27-18)9-5-13(16(23)24)6-11-20(14,19)26/h3-5,8,14,26H,6-7,9-11H2,1-2H3,(H,21,22)(H,23,24)/b8-3u,12-4+/t14?,18-,19-,20+/m1/s1
C20H24O7376.40041100

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