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 5 results

Search term: XKRXUCXHOLPCGB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4143271

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C17H27NO3/c1-2-3-4-14(15(19)20)18-16(21)17-8-11-5-12(9-17)7-13(6-11)10-17/h11-14H,2-10H2,1H3,(H,18,21)(H,19,20)
C17H27NO3293.40118211200
5472341

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C17H27NO3/c1-2-3-4-14(15(19)20)18-16(21)17-8-11-5-12(9-17)7-13(6-11)10-17/h11-14H,2-10H2,1H3,(H,18,21)(H,19,20)/t11?,12?,13?,14-,17?/m0/s1
C17H27NO3293.40126500
5472343

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C17H27NO3/c1-2-3-4-14(15(19)20)18-16(21)17-8-11-5-12(9-17)7-13(6-11)10-17/h11-14H,2-10H2,1H3,(H,18,21)(H,19,20)/t11?,12?,13?,14-,17?/m1/s1
C17H27NO3293.40123200
5472342

Charge

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C17H27NO3/c1-2-3-4-14(15(19)20)18-16(21)17-8-11-5-12(9-17)7-13(6-11)10-17/h11-14H,2-10H2,1H3,(H,18,21)(H,19,20)/p-1/t11?,12?,13?,14-,17?/m1/s1
C17H26NO3292.39381100
5472340

Charge

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C17H27NO3/c1-2-3-4-14(15(19)20)18-16(21)17-8-11-5-12(9-17)7-13(6-11)10-17/h11-14H,2-10H2,1H3,(H,18,21)(H,19,20)/p-1/t11?,12?,13?,14-,17?/m0/s1
C17H26NO3292.39381100

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