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: QRHAHDRSXMWKPA (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3533660

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C23H31NO4/c1-2-7-28-19-5-3-18(4-6-19)20(11-21(25)26)24-22(27)23-12-15-8-16(13-23)10-17(9-15)14-23/h3-6,15-17,20H,2,7-14H2,1H3,(H,24,27)(H,25,26)
C23H31NO4385.49654171200
5623328

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C23H31NO4/c1-2-7-28-19-5-3-18(4-6-19)20(11-21(25)26)24-22(27)23-12-15-8-16(13-23)10-17(9-15)14-23/h3-6,15-17,20H,2,7-14H2,1H3,(H,24,27)(H,25,26)/t15?,16?,17?,20-,23?/m1/s1
C23H31NO4385.49652100
5623330

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C23H31NO4/c1-2-7-28-19-5-3-18(4-6-19)20(11-21(25)26)24-22(27)23-12-15-8-16(13-23)10-17(9-15)14-23/h3-6,15-17,20H,2,7-14H2,1H3,(H,24,27)(H,25,26)/t15?,16?,17?,20-,23?/m0/s1
C23H31NO4385.49652100
5623329

Charge

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C23H31NO4/c1-2-7-28-19-5-3-18(4-6-19)20(11-21(25)26)24-22(27)23-12-15-8-16(13-23)10-17(9-15)14-23/h3-6,15-17,20H,2,7-14H2,1H3,(H,24,27)(H,25,26)/p-1/t15?,16?,17?,20-,23?/m0/s1
C23H30NO4384.48911100
5623327

Charge

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C23H31NO4/c1-2-7-28-19-5-3-18(4-6-19)20(11-21(25)26)24-22(27)23-12-15-8-16(13-23)10-17(9-15)14-23/h3-6,15-17,20H,2,7-14H2,1H3,(H,24,27)(H,25,26)/p-1/t15?,16?,17?,20-,23?/m1/s1
C23H30NO4384.48911100

Advertisement