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: KLIQHXGWRWXCRT (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
25997452

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C29H30N2O6/c1-29(2,3)37-27(34)30-16-18-12-14-19(15-13-18)25(26(32)33)31-28(35)36-17-24-22-10-6-4-8-20(22)21-9-5-7-11-23(21)24/h4-15,24-25H,16-17H2,1-3H3,(H,30,34)(H,31,35)(H,32,33)/t25-/m0/s1
C29H30N2O6502.558310900
57258597

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C29H30N2O6/c1-29(2,3)37-27(34)30-16-18-12-14-19(15-13-18)25(26(32)33)31-28(35)36-17-24-22-10-6-4-8-20(22)21-9-5-7-11-23(21)24/h4-15,24-25H,16-17H2,1-3H3,(H,30,34)(H,31,35)(H,32,33)
C29H30N2O6502.55834300
21227730

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C29H30N2O6/c1-29(2,3)37-27(34)30-16-18-12-14-19(15-13-18)25(26(32)33)31-28(35)36-17-24-22-10-6-4-8-20(22)21-9-5-7-11-23(21)24/h4-15,24-25H,16-17H2,1-3H3,(H,30,34)(H,31,35)(H,32,33)/p-1/t25-/m0/s1
C29H29N2O6501.55091100

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