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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 13 results

Search term: AVBLSPPEZPLINV (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
79300759

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C23H32O7/c1-14(24)16(25)8-5-6-9-18(26)30-17-12-15-13-29-20(27)23(15,28)22(4)11-7-10-21(2,3)19(17)22/h5-6,8-9,12,14,16-17,19,24-25,28H,7,10-11,13H2,1-4H3/b8-5+,9-6+/t14-,16-,17+,19-,22-,23-/m0/s1
C23H32O7420.4967600
23550575

Double-bond stereo

3 of 6 defined stereocentres - 3/6 defined
InChI=1/C23H32O7/c1-14(24)16(25)8-5-6-9-18(26)30-17-12-15-13-29-20(27)23(15,28)22(4)11-7-10-21(2,3)19(17)22/h5-6,8-9,12,14,16-17,19,24-25,28H,7,10-11,13H2,1-4H3/b8-5+,9-6+/t14?,16?,17-,19?,22+,23+/m1/s1
C23H32O7420.4966400
24656900

Double-bond stereo

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C23H32O7/c1-14(24)16(25)8-5-6-9-18(26)30-17-12-15-13-29-20(27)23(15,28)22(4)11-7-10-21(2,3)19(17)22/h5-6,8-9,12,14,16-17,19,24-25,28H,7,10-11,13H2,1-4H3/b8-5+,9-6+/t14?,16?,17-,19+,22+,23+/m1/s1
C23H32O7420.4964600
62415740

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C23H32O7/c1-14(24)16(25)8-5-6-9-18(26)30-17-12-15-13-29-20(27)23(15,28)22(4)11-7-10-21(2,3)19(17)22/h5-6,8-9,12,14,16-17,19,24-25,28H,7,10-11,13H2,1-4H3/b8-5+,9-6+/t14-,16+,17+,19-,22-,23-/m0/s1
C23H32O7420.4964400
62415754

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C23H32O7/c1-14(24)16(25)8-5-6-9-18(26)30-17-12-15-13-29-20(27)23(15,28)22(4)11-7-10-21(2,3)19(17)22/h5-6,8-9,12,14,16-17,19,24-25,28H,7,10-11,13H2,1-4H3/b8-5+,9-6+/t14-,16-,17-,19+,22-,23-/m1/s1
C23H32O7420.4962200
62563636

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C23H32O7/c1-14(24)16(25)8-5-6-9-18(26)30-17-12-15-13-29-20(27)23(15,28)22(4)11-7-10-21(2,3)19(17)22/h5-6,8-9,12,14,16-17,19,24-25,28H,7,10-11,13H2,1-4H3/b8-5+,9-6+/t14-,16-,17+,19+,22-,23-/m0/s1
C23H32O7420.4962200
62563637

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C23H32O7/c1-14(24)16(25)8-5-6-9-18(26)30-17-12-15-13-29-20(27)23(15,28)22(4)11-7-10-21(2,3)19(17)22/h5-6,8-9,12,14,16-17,19,24-25,28H,7,10-11,13H2,1-4H3/b8-5+,9-6+/t14-,16-,17-,19-,22+,23+/m1/s1
C23H32O7420.4962200
79300758

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C23H32O7/c1-14(24)16(25)8-5-6-9-18(26)30-17-12-15-13-29-20(27)23(15,28)22(4)11-7-10-21(2,3)19(17)22/h5-6,8-9,12,14,16-17,19,24-25,28H,7,10-11,13H2,1-4H3/b8-5+,9-6+/t14-,16-,17-,19+,22+,23+/m1/s1
C23H32O7420.4962200
79300760

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C23H32O7/c1-14(24)16(25)8-5-6-9-18(26)30-17-12-15-13-29-20(27)23(15,28)22(4)11-7-10-21(2,3)19(17)22/h5-6,8-9,12,14,16-17,19,24-25,28H,7,10-11,13H2,1-4H3/b8-5+,9-6+/t14-,16+,17-,19+,22+,23+/m1/s1
C23H32O7420.4962200
123961377

Double-bond stereo

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C23H32O7/c1-14(24)16(25)8-5-6-9-18(26)30-17-12-15-13-29-20(27)23(15,28)22(4)11-7-10-21(2,3)19(17)22/h5-6,8-9,12,14,16-17,19,24-25,28H,7,10-11,13H2,1-4H3/b8-5u,9-6+
C23H32O7420.4962300
127409014

Double-bond stereo

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C23H32O7/c1-14(24)16(25)8-5-6-9-18(26)30-17-12-15-13-29-20(27)23(15,28)22(4)11-7-10-21(2,3)19(17)22/h5-6,8-9,12,14,16-17,19,24-25,28H,7,10-11,13H2,1-4H3/b8-5+,9-6+
C23H32O7420.4962200
95533492

Double-bond stereo

3 of 6 defined stereocentres - 3/6 defined
InChI=1/C23H32O7/c1-14(24)16(25)8-5-6-9-18(26)30-17-12-15-13-29-20(27)23(15,28)22(4)11-7-10-21(2,3)19(17)22/h5-6,8-9,12,14,16-17,19,24-25,28H,7,10-11,13H2,1-4H3/b8-5+,9-6+/t14?,16?,17?,19-,22-,23-/m0/s1
C23H32O7420.4961100
113610552

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C23H32O7/c1-14(24)16(25)8-5-6-9-18(26)30-17-12-15-13-29-20(27)23(15,28)22(4)11-7-10-21(2,3)19(17)22/h5-6,8-9,12,14,16-17,19,24-25,28H,7,10-11,13H2,1-4H3/b8-5+,9-6u/t14-,16-,17+,19-,22+,23+/m0/s1
C23H32O7420.4961100

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