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 9 results

Search term: DPGYGRXEBIESJS (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4102373

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C25H35NO3/c1-16-3-5-18(6-4-16)12-22(17(2)24(28)29)23(27)26-8-7-25-13-19-9-20(14-25)11-21(10-19)15-25/h3-6,17,19-22H,7-15H2,1-2H3,(H,26,27)(H,28,29)
C25H35NO3397.5503151000
5651806

2 of 6 defined stereocentres - 2/6 defined
InChI=1/C25H35NO3/c1-16-3-5-18(6-4-16)12-22(17(2)24(28)29)23(27)26-8-7-25-13-19-9-20(14-25)11-21(10-19)15-25/h3-6,17,19-22H,7-15H2,1-2H3,(H,26,27)(H,28,29)/t17-,19?,20?,21?,22+,25?/m1/s1
C25H35NO3397.55032100
5651808

2 of 6 defined stereocentres - 2/6 defined
InChI=1/C25H35NO3/c1-16-3-5-18(6-4-16)12-22(17(2)24(28)29)23(27)26-8-7-25-13-19-9-20(14-25)11-21(10-19)15-25/h3-6,17,19-22H,7-15H2,1-2H3,(H,26,27)(H,28,29)/t17-,19?,20?,21?,22-,25?/m1/s1
C25H35NO3397.55032100
5651810

2 of 6 defined stereocentres - 2/6 defined
InChI=1/C25H35NO3/c1-16-3-5-18(6-4-16)12-22(17(2)24(28)29)23(27)26-8-7-25-13-19-9-20(14-25)11-21(10-19)15-25/h3-6,17,19-22H,7-15H2,1-2H3,(H,26,27)(H,28,29)/t17-,19?,20?,21?,22-,25?/m0/s1
C25H35NO3397.55032100
5651812

2 of 6 defined stereocentres - 2/6 defined
InChI=1/C25H35NO3/c1-16-3-5-18(6-4-16)12-22(17(2)24(28)29)23(27)26-8-7-25-13-19-9-20(14-25)11-21(10-19)15-25/h3-6,17,19-22H,7-15H2,1-2H3,(H,26,27)(H,28,29)/t17-,19?,20?,21?,22+,25?/m0/s1
C25H35NO3397.55032100
5651811

Charge

2 of 6 defined stereocentres - 2/6 defined
InChI=1/C25H35NO3/c1-16-3-5-18(6-4-16)12-22(17(2)24(28)29)23(27)26-8-7-25-13-19-9-20(14-25)11-21(10-19)15-25/h3-6,17,19-22H,7-15H2,1-2H3,(H,26,27)(H,28,29)/p-1/t17-,19?,20?,21?,22+,25?/m0/s1
C25H34NO3396.54291100
5651809

Charge

2 of 6 defined stereocentres - 2/6 defined
InChI=1/C25H35NO3/c1-16-3-5-18(6-4-16)12-22(17(2)24(28)29)23(27)26-8-7-25-13-19-9-20(14-25)11-21(10-19)15-25/h3-6,17,19-22H,7-15H2,1-2H3,(H,26,27)(H,28,29)/p-1/t17-,19?,20?,21?,22-,25?/m0/s1
C25H34NO3396.54291100
5651807

Charge

2 of 6 defined stereocentres - 2/6 defined
InChI=1/C25H35NO3/c1-16-3-5-18(6-4-16)12-22(17(2)24(28)29)23(27)26-8-7-25-13-19-9-20(14-25)11-21(10-19)15-25/h3-6,17,19-22H,7-15H2,1-2H3,(H,26,27)(H,28,29)/p-1/t17-,19?,20?,21?,22-,25?/m1/s1
C25H34NO3396.54291100
5651805

Charge

2 of 6 defined stereocentres - 2/6 defined
InChI=1/C25H35NO3/c1-16-3-5-18(6-4-16)12-22(17(2)24(28)29)23(27)26-8-7-25-13-19-9-20(14-25)11-21(10-19)15-25/h3-6,17,19-22H,7-15H2,1-2H3,(H,26,27)(H,28,29)/p-1/t17-,19?,20?,21?,22+,25?/m1/s1
C25H34NO3396.54291100

Advertisement