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: FYDUXUJLMBAFGB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2271926

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H19N2O8P/c1-7-4-14(12(16)13-11(7)15)10-3-8(20-2)9(22-10)5-21-6-23(17,18)19/h4,8-10H,3,5-6H2,1-2H3,(H,13,15,16)(H2,17,18,19)/t8-,9+,10+/m0/s1
C12H19N2O8P350.2616214400
398374

Charge

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H19N2O8P/c1-7-4-14(12(16)13-11(7)15)10-3-8(20-2)9(22-10)5-21-6-23(17,18)19/h4,8-10H,3,5-6H2,1-2H3,(H,13,15,16)(H2,17,18,19)/p-2/t8-,9+,10+/m0/s1
C12H17N2O8P348.24683300
25064404

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C12H19N2O8P/c1-7-4-14(12(16)13-11(7)15)10-3-8(20-2)9(22-10)5-21-6-23(17,18)19/h4,8-10H,3,5-6H2,1-2H3,(H,13,15,16)(H2,17,18,19)/t8-,9-,10?/m1/s1
C12H19N2O8P350.26162200

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