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
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Found 2 results

Search term: FEGMMKWHKGLVKI (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8826217

Double-bond stereo

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C33H38O9/c1-15(2)8-9-18-26-19(14-22(40-26)30(4,5)39)24(34)23-25(35)20-12-17-13-21-31(6,7)42-32(28(17)36,11-10-16(3)29(37)38)33(20,21)41-27(18)23/h8,10,12,17,21-22,34,39H,9,11,13-14H2,1-7H3,(H,37,38)/b16-10-/t17-,21-,22?,32+,33-/m0/s1
C33H38O9578.64942100
10286096

Double-bond stereo

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C33H38O9/c1-15(2)8-9-18-26-19(14-22(40-26)30(4,5)39)24(34)23-25(35)20-12-17-13-21-31(6,7)42-32(28(17)36,11-10-16(3)29(37)38)33(20,21)41-27(18)23/h8,10,12,17,21-22,34,39H,9,11,13-14H2,1-7H3,(H,37,38)/b16-10-/t17-,21?,22?,32+,33-/m0/s1
C33H38O9578.64941100

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