Matches any text strings used to describe a molecule.
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 5 results

Search term: DOLXLUJRDMTXBB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3810125

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H27N7O3S/c1-13-7-4-5-9-15(13)29-19(14-8-6-10-24-11-14)25-26-21(29)33-12-16(30)17-18(23)27(2)22(32)28(3)20(17)31/h6,8,10-11,13,15H,4-5,7,9,12,23H2,1-3H3
C22H27N7O3S469.559912800
62475231

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H27N7O3S/c1-13-7-4-5-9-15(13)29-19(14-8-6-10-24-11-14)25-26-21(29)33-12-16(30)17-18(23)27(2)22(32)28(3)20(17)31/h6,8,10-11,13,15H,4-5,7,9,12,23H2,1-3H3/t13-,15-/m0/s1
C22H27N7O3S469.55992200
62562558

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H27N7O3S/c1-13-7-4-5-9-15(13)29-19(14-8-6-10-24-11-14)25-26-21(29)33-12-16(30)17-18(23)27(2)22(32)28(3)20(17)31/h6,8,10-11,13,15H,4-5,7,9,12,23H2,1-3H3/t13-,15+/m1/s1
C22H27N7O3S469.55992200
62569815

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H27N7O3S/c1-13-7-4-5-9-15(13)29-19(14-8-6-10-24-11-14)25-26-21(29)33-12-16(30)17-18(23)27(2)22(32)28(3)20(17)31/h6,8,10-11,13,15H,4-5,7,9,12,23H2,1-3H3/t13-,15-/m1/s1
C22H27N7O3S469.55992200
62693931

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H27N7O3S/c1-13-7-4-5-9-15(13)29-19(14-8-6-10-24-11-14)25-26-21(29)33-12-16(30)17-18(23)27(2)22(32)28(3)20(17)31/h6,8,10-11,13,15H,4-5,7,9,12,23H2,1-3H3/t13-,15+/m0/s1
C22H27N7O3S469.55992200

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