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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 27 results

Search term: BEFZAMRWPCMWFJ (Found by InChIKey (skeleton match))
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8066896

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H39NO5S/c1-16-11-9-7-8-10-12-21(17(2)13-20-15-33-19(4)27-20)32-23(29)14-22(28)26(5,6)25(31)18(3)24(16)30/h8,10,13,15-16,18,21-22,24,28,30H,7,9,11-12,14H2,1-6H3/b10-8-,17-13+/t16-,18+,21-,22-,24-/m0/s1
C26H39NO5S477.656625281214
8989799

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H39NO5S/c1-16-11-9-7-8-10-12-21(17(2)13-20-15-33-19(4)27-20)32-23(29)14-22(28)26(5,6)25(31)18(3)24(16)30/h8,10,13,15-16,18,21-22,24,28,30H,7,9,11-12,14H2,1-6H3/b10-8+,17-13+/t16-,18+,21-,22-,24-/m0/s1
C26H39NO5S477.65668900
8045352

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H39NO5S/c1-16-11-9-7-8-10-12-21(17(2)13-20-15-33-19(4)27-20)32-23(29)14-22(28)26(5,6)25(31)18(3)24(16)30/h8,10,13,15-16,18,21-22,24,28,30H,7,9,11-12,14H2,1-6H3/b10-8-,17-13+/t16-,18-,21+,22+,24-/m1/s1
C26H39NO5S477.65663200
8110395

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H39NO5S/c1-16-11-9-7-8-10-12-21(17(2)13-20-15-33-19(4)27-20)32-23(29)14-22(28)26(5,6)25(31)18(3)24(16)30/h8,10,13,15-16,18,21-22,24,28,30H,7,9,11-12,14H2,1-6H3/b10-8+,17-13+/t16-,18-,21-,22-,24-/m0/s1
C26H39NO5S477.65663100
8680220

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H39NO5S/c1-16-11-9-7-8-10-12-21(17(2)13-20-15-33-19(4)27-20)32-23(29)14-22(28)26(5,6)25(31)18(3)24(16)30/h8,10,13,15-16,18,21-22,24,28,30H,7,9,11-12,14H2,1-6H3/b10-8-,17-13+/t16-,18-,21+,22+,24+/m1/s1
C26H39NO5S477.65662100
8704030

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H39NO5S/c1-16-11-9-7-8-10-12-21(17(2)13-20-15-33-19(4)27-20)32-23(29)14-22(28)26(5,6)25(31)18(3)24(16)30/h8,10,13,15-16,18,21-22,24,28,30H,7,9,11-12,14H2,1-6H3/b10-8-,17-13+/t16-,18+,21-,22+,24-/m0/s1
C26H39NO5S477.65662100
8751989

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H39NO5S/c1-16-11-9-7-8-10-12-21(17(2)13-20-15-33-19(4)27-20)32-23(29)14-22(28)26(5,6)25(31)18(3)24(16)30/h8,10,13,15-16,18,21-22,24,28,30H,7,9,11-12,14H2,1-6H3/b10-8+,17-13+/t16-,18-,21+,22-,24+/m1/s1
C26H39NO5S477.65662100
8776074

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H39NO5S/c1-16-11-9-7-8-10-12-21(17(2)13-20-15-33-19(4)27-20)32-23(29)14-22(28)26(5,6)25(31)18(3)24(16)30/h8,10,13,15-16,18,21-22,24,28,30H,7,9,11-12,14H2,1-6H3/b10-8-,17-13+/t16-,18+,21+,22-,24-/m1/s1
C26H39NO5S477.65662100
8823664

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H39NO5S/c1-16-11-9-7-8-10-12-21(17(2)13-20-15-33-19(4)27-20)32-23(29)14-22(28)26(5,6)25(31)18(3)24(16)30/h8,10,13,15-16,18,21-22,24,28,30H,7,9,11-12,14H2,1-6H3/b10-8+,17-13+/t16-,18+,21+,22-,24-/m1/s1
C26H39NO5S477.65662100
8871333

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H39NO5S/c1-16-11-9-7-8-10-12-21(17(2)13-20-15-33-19(4)27-20)32-23(29)14-22(28)26(5,6)25(31)18(3)24(16)30/h8,10,13,15-16,18,21-22,24,28,30H,7,9,11-12,14H2,1-6H3/b10-8+,17-13+/t16-,18-,21+,22+,24+/m1/s1
C26H39NO5S477.65662100
8918583

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H39NO5S/c1-16-11-9-7-8-10-12-21(17(2)13-20-15-33-19(4)27-20)32-23(29)14-22(28)26(5,6)25(31)18(3)24(16)30/h8,10,13,15-16,18,21-22,24,28,30H,7,9,11-12,14H2,1-6H3/b10-8+,17-13+/t16-,18+,21-,22+,24-/m0/s1
C26H39NO5S477.65662100
8918584

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H39NO5S/c1-16-11-9-7-8-10-12-21(17(2)13-20-15-33-19(4)27-20)32-23(29)14-22(28)26(5,6)25(31)18(3)24(16)30/h8,10,13,15-16,18,21-22,24,28,30H,7,9,11-12,14H2,1-6H3/b10-8-,17-13+/t16-,18-,21-,22+,24+/m0/s1
C26H39NO5S477.65662100
8942311

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H39NO5S/c1-16-11-9-7-8-10-12-21(17(2)13-20-15-33-19(4)27-20)32-23(29)14-22(28)26(5,6)25(31)18(3)24(16)30/h8,10,13,15-16,18,21-22,24,28,30H,7,9,11-12,14H2,1-6H3/b10-8-,17-13+/t16-,18+,21+,22+,24-/m1/s1
C26H39NO5S477.65662100
8942312

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H39NO5S/c1-16-11-9-7-8-10-12-21(17(2)13-20-15-33-19(4)27-20)32-23(29)14-22(28)26(5,6)25(31)18(3)24(16)30/h8,10,13,15-16,18,21-22,24,28,30H,7,9,11-12,14H2,1-6H3/b10-8+,17-13+/t16-,18-,21+,22-,24+/m0/s1
C26H39NO5S477.65662100
8989800

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H39NO5S/c1-16-11-9-7-8-10-12-21(17(2)13-20-15-33-19(4)27-20)32-23(29)14-22(28)26(5,6)25(31)18(3)24(16)30/h8,10,13,15-16,18,21-22,24,28,30H,7,9,11-12,14H2,1-6H3/b10-8-,17-13+/t16-,18+,21+,22-,24-/m0/s1
C26H39NO5S477.65662100
9013651

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H39NO5S/c1-16-11-9-7-8-10-12-21(17(2)13-20-15-33-19(4)27-20)32-23(29)14-22(28)26(5,6)25(31)18(3)24(16)30/h8,10,13,15-16,18,21-22,24,28,30H,7,9,11-12,14H2,1-6H3/b10-8+,17-13+/t16-,18+,21+,22+,24-/m1/s1
C26H39NO5S477.65662100
9973503

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H39NO5S/c1-16-11-9-7-8-10-12-21(17(2)13-20-15-33-19(4)27-20)32-23(29)14-22(28)26(5,6)25(31)18(3)24(16)30/h8,10,13,15-16,18,21-22,24,28,30H,7,9,11-12,14H2,1-6H3/b10-8+,17-13+/t16-,18-,21-,22+,24+/m0/s1
C26H39NO5S477.65662100
9973504

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H39NO5S/c1-16-11-9-7-8-10-12-21(17(2)13-20-15-33-19(4)27-20)32-23(29)14-22(28)26(5,6)25(31)18(3)24(16)30/h8,10,13,15-16,18,21-22,24,28,30H,7,9,11-12,14H2,1-6H3/b10-8+,17-13+/t16-,18+,21+,22-,24-/m0/s1
C26H39NO5S477.65662100
114814304

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H39NO5S/c1-16-11-9-7-8-10-12-21(17(2)13-20-15-33-19(4)27-20)32-23(29)14-22(28)26(5,6)25(31)18(3)24(16)30/h8,10,13,15-16,18,21-22,24,28,30H,7,9,11-12,14H2,1-6H3/b10-8+,17-13u/t16-,18+,21-,22-,24-/m0/s1
C26H39NO5S477.65661100
12

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