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: PTGJRCWJYMIUCT (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2540793

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C25H31NO7/c1-5-9-32-10-11-33-25(30)20-15(3)26-18-12-14(2)19(24(29)31-4)23(28)22(18)21(20)16-7-6-8-17(27)13-16/h6-8,13-14,19,21,26-27H,5,9-12H2,1-4H3
C25H31NO7457.516114800
62291736

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C25H31NO7/c1-5-9-32-10-11-33-25(30)20-15(3)26-18-12-14(2)19(24(29)31-4)23(28)22(18)21(20)16-7-6-8-17(27)13-16/h6-8,13-14,19,21,26-27H,5,9-12H2,1-4H3/t14-,19+,21-/m1/s1
C25H31NO7457.51612200
62291737

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C25H31NO7/c1-5-9-32-10-11-33-25(30)20-15(3)26-18-12-14(2)19(24(29)31-4)23(28)22(18)21(20)16-7-6-8-17(27)13-16/h6-8,13-14,19,21,26-27H,5,9-12H2,1-4H3/t14-,19+,21+/m1/s1
C25H31NO7457.51612200
62466304

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C25H31NO7/c1-5-9-32-10-11-33-25(30)20-15(3)26-18-12-14(2)19(24(29)31-4)23(28)22(18)21(20)16-7-6-8-17(27)13-16/h6-8,13-14,19,21,26-27H,5,9-12H2,1-4H3/t14-,19-,21-/m0/s1
C25H31NO7457.51612200
62689993

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C25H31NO7/c1-5-9-32-10-11-33-25(30)20-15(3)26-18-12-14(2)19(24(29)31-4)23(28)22(18)21(20)16-7-6-8-17(27)13-16/h6-8,13-14,19,21,26-27H,5,9-12H2,1-4H3/t14-,19-,21+/m0/s1
C25H31NO7457.51612200

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