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 3 results

Search term: CRGRDXJUAXSDHN (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2771053

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H28N2O7/c1-33-20-9-5-7-18(26(20)34-2)23-22(24(30)21-16-17-6-3-4-8-19(17)36-21)25(31)27(32)29(23)11-10-28-12-14-35-15-13-28/h3-9,16,23,31H,10-15H2,1-2H3
C27H28N2O7492.52042161100
1252317

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C27H28N2O7/c1-33-20-9-5-7-18(26(20)34-2)23-22(24(30)21-16-17-6-3-4-8-19(17)36-21)25(31)27(32)29(23)11-10-28-12-14-35-15-13-28/h3-9,16,23,31H,10-15H2,1-2H3/t23-/m0/s1
C27H28N2O7492.52042100
5363083

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C27H28N2O7/c1-33-20-9-5-7-18(26(20)34-2)23-22(24(30)21-16-17-6-3-4-8-19(17)36-21)25(31)27(32)29(23)11-10-28-12-14-35-15-13-28/h3-9,16,23,31H,10-15H2,1-2H3/p+1/t23-/m0/s1
C27H29N2O7493.52781100

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