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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 18 results

Search term: NWKPOVHSHWJQNI (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
24822055

Double-bond stereo

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C23H40O7/c1-2-3-6-9-17(25)12-13-20-19(21(27)14-22(20)28)10-7-4-5-8-11-23(29)30-16-18(26)15-24/h4,7,12-13,17-22,24-28H,2-3,5-6,8-11,14-16H2,1H3/b7-4-,13-12+/t17-,18?,19+,20+,21-,22+/m0/s1
C23H40O7428.5595202200
28589710

Double-bond stereo

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C23H40O7/c1-2-3-6-9-17(25)12-13-20-19(21(27)14-22(20)28)10-7-4-5-8-11-23(29)30-16-18(26)15-24/h4,7,12-13,17-22,24-28H,2-3,5-6,8-11,14-16H2,1H3/b7-4+,13-12+
C23H40O7428.55955500
29342056

Double-bond stereo

5 of 6 defined stereocentres - 5/6 defined

Non-standard isotope
InChI=1/C23H40O7/c1-2-3-6-9-17(25)12-13-20-19(21(27)14-22(20)28)10-7-4-5-8-11-23(29)30-16-18(26)15-24/h4,7,12-13,17-22,24-28H,2-3,5-6,8-11,14-16H2,1H3/b7-4-,13-12+/t17-,18?,19+,20+,21-,22+/m0/s1/i15D2,16D2,18D
C23H35D5O7433.59035500
62400390

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C23H40O7/c1-2-3-6-9-17(25)12-13-20-19(21(27)14-22(20)28)10-7-4-5-8-11-23(29)30-16-18(26)15-24/h4,7,12-13,17-22,24-28H,2-3,5-6,8-11,14-16H2,1H3/b7-4-,13-12+/t17-,18+,19-,20+,21-,22+/m1/s1
C23H40O7428.55952200
62400391

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C23H40O7/c1-2-3-6-9-17(25)12-13-20-19(21(27)14-22(20)28)10-7-4-5-8-11-23(29)30-16-18(26)15-24/h4,7,12-13,17-22,24-28H,2-3,5-6,8-11,14-16H2,1H3/b7-4-,13-12+/t17-,18-,19+,20+,21+,22-/m0/s1
C23H40O7428.55952200
62478913

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C23H40O7/c1-2-3-6-9-17(25)12-13-20-19(21(27)14-22(20)28)10-7-4-5-8-11-23(29)30-16-18(26)15-24/h4,7,12-13,17-22,24-28H,2-3,5-6,8-11,14-16H2,1H3/b7-4-,13-12+/t17-,18-,19+,20-,21-,22+/m0/s1
C23H40O7428.55952200
62478918

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C23H40O7/c1-2-3-6-9-17(25)12-13-20-19(21(27)14-22(20)28)10-7-4-5-8-11-23(29)30-16-18(26)15-24/h4,7,12-13,17-22,24-28H,2-3,5-6,8-11,14-16H2,1H3/b7-4-,13-12+/t17-,18-,19-,20-,21+,22-/m1/s1
C23H40O7428.55952200
62568998

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C23H40O7/c1-2-3-6-9-17(25)12-13-20-19(21(27)14-22(20)28)10-7-4-5-8-11-23(29)30-16-18(26)15-24/h4,7,12-13,17-22,24-28H,2-3,5-6,8-11,14-16H2,1H3/b7-4-,13-12+/t17-,18-,19-,20+,21+,22-/m1/s1
C23H40O7428.55952200
62569001

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C23H40O7/c1-2-3-6-9-17(25)12-13-20-19(21(27)14-22(20)28)10-7-4-5-8-11-23(29)30-16-18(26)15-24/h4,7,12-13,17-22,24-28H,2-3,5-6,8-11,14-16H2,1H3/b7-4-,13-12+/t17-,18-,19+,20+,21-,22+/m0/s1
C23H40O7428.55952200
62570038

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C23H40O7/c1-2-3-6-9-17(25)12-13-20-19(21(27)14-22(20)28)10-7-4-5-8-11-23(29)30-16-18(26)15-24/h4,7,12-13,17-22,24-28H,2-3,5-6,8-11,14-16H2,1H3/b7-4-,13-12+/t17-,18+,19-,20-,21-,22+/m1/s1
C23H40O7428.55952200
62570043

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C23H40O7/c1-2-3-6-9-17(25)12-13-20-19(21(27)14-22(20)28)10-7-4-5-8-11-23(29)30-16-18(26)15-24/h4,7,12-13,17-22,24-28H,2-3,5-6,8-11,14-16H2,1H3/b7-4-,13-12+/t17-,18+,19+,20+,21-,22+/m0/s1
C23H40O7428.55952300
62573337

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C23H40O7/c1-2-3-6-9-17(25)12-13-20-19(21(27)14-22(20)28)10-7-4-5-8-11-23(29)30-16-18(26)15-24/h4,7,12-13,17-22,24-28H,2-3,5-6,8-11,14-16H2,1H3/b7-4-,13-12+/t17-,18+,19+,20-,21-,22+/m0/s1
C23H40O7428.55952200
95639855

Double-bond stereo

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C23H40O7/c1-2-3-6-9-17(25)12-13-20-19(21(27)14-22(20)28)10-7-4-5-8-11-23(29)30-16-18(26)15-24/h4,7,12-13,17-22,24-28H,2-3,5-6,8-11,14-16H2,1H3/b7-4-,13-12-
C23H40O7428.55951100
117216993

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C23H40O7/c1-2-3-6-9-17(25)12-13-20-19(21(27)14-22(20)28)10-7-4-5-8-11-23(29)30-16-18(26)15-24/h4,7,12-13,17-22,24-28H,2-3,5-6,8-11,14-16H2,1H3/b7-4+,13-12+/t17-,18-,19+,20+,21-,22+/m0/s1
C23H40O7428.55951100

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