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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 8 results

Search term: HUKYPYXOBINMND (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4445264

Double-bond stereo

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C25H43NO7/c1-9-20-25(6,30)11-10-19(27)14(2)12-15(3)22(17(5)23(29)32-20)33-24-21(28)18(26(7)8)13-16(4)31-24/h10-11,14-18,20-22,24,28,30H,9,12-13H2,1-8H3/b11-10+/t14-,15+,16-,17-,18+,20-,21-,22+,24+,25+/m1/s1
C25H43NO7469.611427284548
52083526

Double-bond stereo

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C25H43NO7/c1-9-20-25(6,30)11-10-19(27)14(2)12-15(3)22(17(5)23(29)32-20)33-24-21(28)18(26(7)8)13-16(4)31-24/h10-11,14-18,20-22,24,28,30H,9,12-13H2,1-8H3/b11-10-/t14-,15+,16-,17-,18+,20-,21-,22+,24+,25+/m1/s1
C25H43NO7469.61145500
24890644

Charge

Double-bond stereo

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C25H43NO7/c1-9-20-25(6,30)11-10-19(27)14(2)12-15(3)22(17(5)23(29)32-20)33-24-21(28)18(26(7)8)13-16(4)31-24/h10-11,14-18,20-22,24,28,30H,9,12-13H2,1-8H3/p+1/b11-10+/t14-,15+,16-,17-,18+,20-,21-,22+,24+,25+/m1/s1
C25H44NO7470.61882200
58827788

Double-bond stereo

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C25H43NO7/c1-9-20-25(6,30)11-10-19(27)14(2)12-15(3)22(17(5)23(29)32-20)33-24-21(28)18(26(7)8)13-16(4)31-24/h10-11,14-18,20-22,24,28,30H,9,12-13H2,1-8H3/b11-10+/t14?,15-,16+,17+,18-,20+,21+,22-,24-,25-/m0/s1
C25H43NO7469.61142200
81367563

Double-bond stereo

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C25H43NO7/c1-9-20-25(6,30)11-10-19(27)14(2)12-15(3)22(17(5)23(29)32-20)33-24-21(28)18(26(7)8)13-16(4)31-24/h10-11,14-18,20-22,24,28,30H,9,12-13H2,1-8H3/b11-10+/t14-,15+,16-,17-,18+,20-,21-,22+,24+,25?/m1/s1
C25H43NO7469.61141100
114779241

Double-bond stereo

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C25H43NO7/c1-9-20-25(6,30)11-10-19(27)14(2)12-15(3)22(17(5)23(29)32-20)33-24-21(28)18(26(7)8)13-16(4)31-24/h10-11,14-18,20-22,24,28,30H,9,12-13H2,1-8H3/b11-10-/t14-,15+,16-,17-,18+,20+,21-,22+,24?,25+/m1/s1
C25H43NO7469.61141200
30991726

Double-bond stereo

0 of 10 defined stereocentres - 0/10 defined
InChI=1/C25H43NO7/c1-9-20-25(6,30)11-10-19(27)14(2)12-15(3)22(17(5)23(29)32-20)33-24-21(28)18(26(7)8)13-16(4)31-24/h10-11,14-18,20-22,24,28,30H,9,12-13H2,1-8H3/b11-10+
C25H43NO7469.61141100
58145352

Charge

Double-bond stereo

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C25H43NO7/c1-9-20-25(6,30)11-10-19(27)14(2)12-15(3)22(17(5)23(29)32-20)33-24-21(28)18(26(7)8)13-16(4)31-24/h10-11,14-18,20-22,24,28,30H,9,12-13H2,1-8H3/p+1/b11-10-/t14-,15+,16-,17-,18+,20-,21-,22+,24+,25+/m1/s1
C25H44NO7470.61881200

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