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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: YQYJSBFKSSDGFO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4938630

Double-bond stereo

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C23H29NO12/c1-8(22(32)24-13-14(27)16(29)21-20(15(13)28)33-7-34-21)5-10-3-4-12(11(26)6-10)35-23-18(31)17(30)19(36-23)9(2)25/h3-6,13-21,23,26-31H,7H2,1-2H3,(H,24,32)/b8-5+/t13-,14+,15-,16-,17+,18+,19-,20+,21-,23-/m1/s1
C23H29NO12511.4759212100
16735855

Double-bond stereo

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C23H29NO12/c1-8(22(32)24-13-14(27)16(29)21-20(15(13)28)33-7-34-21)5-10-3-4-12(11(26)6-10)35-23-18(31)17(30)19(36-23)9(2)25/h3-6,13-21,23,26-31H,7H2,1-2H3,(H,24,32)/b8-5+/t13-,14+,15-,16-,17-,18-,19+,20+,21-,23+/m0/s1
C23H29NO12511.4759912152837
4947827

Double-bond stereo

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C23H29NO12/c1-8(22(32)24-13-14(27)16(29)21-20(15(13)28)33-7-34-21)5-10-3-4-12(11(26)6-10)35-23-18(31)17(30)19(36-23)9(2)25/h3-6,13-21,23,26-31H,7H2,1-2H3,(H,24,32)/b8-5+/t13-,14+,15-,16-,17+,18+,19+,20+,21-,23-/m1/s1
C23H29NO12511.47593300
8111793

Double-bond stereo

8 of 10 defined stereocentres - 8/10 defined
InChI=1/C23H29NO12/c1-8(22(32)24-13-14(27)16(29)21-20(15(13)28)33-7-34-21)5-10-3-4-12(11(26)6-10)35-23-18(31)17(30)19(36-23)9(2)25/h3-6,13-21,23,26-31H,7H2,1-2H3,(H,24,32)/b8-5+/t13-,14+,15+,16-,17-,18-,19+,20?,21?,23-/m0/s1
C23H29NO12511.47592100
8133630

Double-bond stereo

8 of 10 defined stereocentres - 8/10 defined
InChI=1/C23H29NO12/c1-8(22(32)24-13-14(27)16(29)21-20(15(13)28)33-7-34-21)5-10-3-4-12(11(26)6-10)35-23-18(31)17(30)19(36-23)9(2)25/h3-6,13-21,23,26-31H,7H2,1-2H3,(H,24,32)/b8-5+/t13-,14+,15-,16-,17-,18-,19+,20?,21?,23+/m0/s1
C23H29NO12511.47592100
9641221

Double-bond stereo

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C23H29NO12/c1-8(22(32)24-13-14(27)16(29)21-20(15(13)28)33-7-34-21)5-10-3-4-12(11(26)6-10)35-23-18(31)17(30)19(36-23)9(2)25/h3-6,13-21,23,26-31H,7H2,1-2H3,(H,24,32)/b8-5+/t13-,14+,15-,16-,17+,18-,19-,20+,21-,23-/m1/s1
C23H29NO12511.47592100
23107924

Double-bond stereo

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C23H29NO12/c1-8(22(32)24-13-14(27)16(29)21-20(15(13)28)33-7-34-21)5-10-3-4-12(11(26)6-10)35-23-18(31)17(30)19(36-23)9(2)25/h3-6,13-21,23,26-31H,7H2,1-2H3,(H,24,32)/b8-5-/t13-,14-,15-,16-,17+,18+,19-,20+,21-,23-/m1/s1
C23H29NO12511.47592200
59700865

Double-bond stereo

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C23H29NO12/c1-8(22(32)24-13-14(27)16(29)21-20(15(13)28)33-7-34-21)5-10-3-4-12(11(26)6-10)35-23-18(31)17(30)19(36-23)9(2)25/h3-6,13-21,23,26-31H,7H2,1-2H3,(H,24,32)/b8-5+/t13-,14+,15-,16-,17+,18+,19-,20+,21+,23-/m1/s1
C23H29NO12511.47592100
65791242

Double-bond stereo

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C23H29NO12/c1-8(22(32)24-13-14(27)16(29)21-20(15(13)28)33-7-34-21)5-10-3-4-12(11(26)6-10)35-23-18(31)17(30)19(36-23)9(2)25/h3-6,13-21,23,26-31H,7H2,1-2H3,(H,24,32)/t13-,14-,15+,16+,17+,18+,19-,20-,21+,23-/m1/s1
C23H29NO12511.47591200
128925958

Double-bond stereo

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C23H29NO12/c1-8(22(32)24-13-14(27)16(29)21-20(15(13)28)33-7-34-21)5-10-3-4-12(11(26)6-10)35-23-18(31)17(30)19(36-23)9(2)25/h3-6,13-21,23,26-31H,7H2,1-2H3,(H,24,32)/t13-,14+,15+,16-,17-,18+,19-,20+,21-,23-/m1/s1
C23H29NO12511.47591100
28286630

Double-bond stereo

8 of 10 defined stereocentres - 8/10 defined
InChI=1/C23H29NO12/c1-8(22(32)24-13-14(27)16(29)21-20(15(13)28)33-7-34-21)5-10-3-4-12(11(26)6-10)35-23-18(31)17(30)19(36-23)9(2)25/h3-6,13-21,23,26-31H,7H2,1-2H3,(H,24,32)/b8-5+/t13-,14+,15-,16-,17?,18?,19-,20+,21-,23-/m1/s1
C23H29NO12511.47591100
35035444

Double-bond stereo

0 of 10 defined stereocentres - 0/10 defined
InChI=1/C23H29NO12/c1-8(22(32)24-13-14(27)16(29)21-20(15(13)28)33-7-34-21)5-10-3-4-12(11(26)6-10)35-23-18(31)17(30)19(36-23)9(2)25/h3-6,13-21,23,26-31H,7H2,1-2H3,(H,24,32)/b8-5+/t13-,14-,15+,16+,17+,18+,19-,20-,21+,23-/m1/s1
C23H29NO12511.47591100
58837306

Double-bond stereo

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C23H29NO12/c1-8(22(32)24-13-14(27)16(29)21-20(15(13)28)33-7-34-21)5-10-3-4-12(11(26)6-10)35-23-18(31)17(30)19(36-23)9(2)25/h3-6,13-21,23,26-31H,7H2,1-2H3,(H,24,32)/b8-5+/t13-,14-,15+,16+,17-,18-,19+,20-,21+,23+/m0/s1
C23H29NO12511.47591100

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