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: FJAPTEJQNSKSOD (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
117608

10 of 12 defined stereocentres - 10/12 defined
InChI=1/C30H54O/c1-18(2)21(5)19(3)17-20(4)24-11-12-26-23-9-10-25-22(6)28(31)14-16-30(25,8)27(23)13-15-29(24,26)7/h18-28,31H,9-17H2,1-8H3/t19?,20-,21?,22+,23+,24-,25+,26+,27+,28+,29-,30+/m1/s1
C30H54O430.74924400
29212352

12 of 12 defined stereocentres - 12/12 defined
InChI=1/C30H54O/c1-18(2)21(5)19(3)17-20(4)24-11-12-26-23-9-10-25-22(6)28(31)14-16-30(25,8)27(23)13-15-29(24,26)7/h18-28,31H,9-17H2,1-8H3/t19-,20-,21-,22+,23+,24-,25+,26+,27+,28+,29-,30+/m1/s1
C30H54O430.74922200
29212353

12 of 12 defined stereocentres - 12/12 defined
InChI=1/C30H54O/c1-18(2)21(5)19(3)17-20(4)24-11-12-26-23-9-10-25-22(6)28(31)14-16-30(25,8)27(23)13-15-29(24,26)7/h18-28,31H,9-17H2,1-8H3/t19-,20+,21+,22-,23-,24+,25-,26-,27-,28-,29+,30-/m0/s1
C30H54O430.74922200
19983580

10 of 12 defined stereocentres - 10/12 defined
InChI=1/C30H54O/c1-18(2)21(5)19(3)17-20(4)24-11-12-26-23-9-10-25-22(6)28(31)14-16-30(25,8)27(23)13-15-29(24,26)7/h18-28,31H,9-17H2,1-8H3/t19u,20-,21u,22+,23+,24-,25+,26+,27+,28+,29-,30+/m1/s1
C30H54O430.74921100
19983581

10 of 12 defined stereocentres - 10/12 defined
InChI=1/C30H54O/c1-18(2)21(5)19(3)17-20(4)24-11-12-26-23-9-10-25-22(6)28(31)14-16-30(25,8)27(23)13-15-29(24,26)7/h18-28,31H,9-17H2,1-8H3/t19?,20-,21u,22+,23+,24-,25+,26+,27+,28+,29-,30+/m1/s1
C30H54O430.74921100
24823305

6 of 12 defined stereocentres - 6/12 defined
InChI=1/C30H54O/c1-18(2)21(5)19(3)17-20(4)24-11-12-26-23-9-10-25-22(6)28(31)14-16-30(25,8)27(23)13-15-29(24,26)7/h18-28,31H,9-17H2,1-8H3/t19?,20?,21?,22-,23?,24+,25-,26?,27?,28-,29+,30-/m0/s1
C30H54O430.74921100

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