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 7 results

Search term: PCGFASDDDLYJAC (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
5068615

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C25H30N2O5/c1-3-4-8-13-32-26-19-14-20(28)23(29)21-17(19)11-12-18-22(21)25(31)27(24(18)30)15(2)16-9-6-5-7-10-16/h1,5-7,9-10,15,17-18,20-23,28-29H,4,8,11-14H2,2H3/t15-,17+,18+,20+,21-,22+,23+/m0/s1
C25H30N2O5438.51612100
5068687

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C25H30N2O5/c1-3-4-8-13-32-26-19-14-20(28)23(29)21-17(19)11-12-18-22(21)25(31)27(24(18)30)15(2)16-9-6-5-7-10-16/h1,5-7,9-10,15,17-18,20-23,28-29H,4,8,11-14H2,2H3/t15-,17-,18+,20+,21-,22+,23+/m0/s1
C25H30N2O5438.51612100
7827217

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C25H30N2O5/c1-3-4-8-13-32-26-19-14-20(28)23(29)21-17(19)11-12-18-22(21)25(31)27(24(18)30)15(2)16-9-6-5-7-10-16/h1,5-7,9-10,15,17-18,20-23,28-29H,4,8,11-14H2,2H3/b26-19+/t15-,17+,18+,20+,21-,22+,23+/m0/s1
C25H30N2O5438.51612200
7827255

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C25H30N2O5/c1-3-4-8-13-32-26-19-14-20(28)23(29)21-17(19)11-12-18-22(21)25(31)27(24(18)30)15(2)16-9-6-5-7-10-16/h1,5-7,9-10,15,17-18,20-23,28-29H,4,8,11-14H2,2H3/b26-19+/t15-,17-,18+,20+,21-,22+,23+/m0/s1
C25H30N2O5438.51612200
26369644

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C25H30N2O5/c1-3-4-8-13-32-26-19-14-20(28)23(29)21-17(19)11-12-18-22(21)25(31)27(24(18)30)15(2)16-9-6-5-7-10-16/h1,5-7,9-10,15,17-18,20-23,28-29H,4,8,11-14H2,2H3/b26-19-/t15-,17-,18-,20+,21-,22+,23+/m0/s1
C25H30N2O5438.51612200
26401062

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C25H30N2O5/c1-3-4-8-13-32-26-19-14-20(28)23(29)21-17(19)11-12-18-22(21)25(31)27(24(18)30)15(2)16-9-6-5-7-10-16/h1,5-7,9-10,15,17-18,20-23,28-29H,4,8,11-14H2,2H3/b26-19-/t15-,17+,18-,20+,21-,22+,23+/m0/s1
C25H30N2O5438.51612200
28477429

Double-bond stereo

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C25H30N2O5/c1-3-4-8-13-32-26-19-14-20(28)23(29)21-17(19)11-12-18-22(21)25(31)27(24(18)30)15(2)16-9-6-5-7-10-16/h1,5-7,9-10,15,17-18,20-23,28-29H,4,8,11-14H2,2H3
C25H30N2O5438.51611100

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