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 19 results

Search term: VFRROHXSMXFLSN (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
388984

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C6H13O9P/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h1,3-6,8-11H,2H2,(H2,12,13,14)/t3-,4+,5+,6+/m0/s1
C6H13O9P260.13585731204
4809693

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C6H13O9P/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h1,3-6,8-11H,2H2,(H2,12,13,14)/t3-,4-,5-,6-/m1/s1
C6H13O9P260.13581642400
2299195

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C6H13O9P/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h1,3-6,8-11H,2H2,(H2,12,13,14)/t3-,4+,5+,6-/m0/s1
C6H13O9P260.135781156801
4573662

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C6H13O9P/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h1,3-6,8-11H,2H2,(H2,12,13,14)/t3-,4+,5-,6+/m0/s1
C6H13O9P260.135812900
19952394

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C6H13O9P/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h1,3-6,8-11H,2H2,(H2,12,13,14)/p-2/t3-,4+,5+,6+/m0/s1
C6H11O9P258.1215614361477
19969422

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C6H13O9P/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h1,3-6,8-11H,2H2,(H2,12,13,14)/p-2/t3-,4-,5-,6-/m1/s1
C6H11O9P258.12134498
26563257

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C6H13O9P/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h1,3-6,8-11H,2H2,(H2,12,13,14)/t3-,4+,5-,6-/m0/s1
C6H13O9P260.13583200
2299192

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C6H13O9P/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h1,3-6,8-11H,2H2,(H2,12,13,14)/t3-,4-,5+,6+/m0/s1
C6H13O9P260.1357813200
9131531

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C6H13O9P/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h1,3-6,8-11H,2H2,(H2,12,13,14)/t3-,4+,5+,6+/m0/s1/i1+1
C513CH13O9P261.12842200
18558584

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C6H13O9P/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h1,3-6,8-11H,2H2,(H2,12,13,14)/t3-,4+,5+,6+/m1/s1
C6H13O9P260.13582100
19974566

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C6H13O9P/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h1,3-6,8-11H,2H2,(H2,12,13,14)/p-2/t3-,4+,5+,6-/m0/s1
C6H11O9P258.1212100
24534258

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C6H13O9P/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h1,3-6,8-11H,2H2,(H2,12,13,14)/t3-,4?,5+,6+/m0/s1
C6H13O9P260.13581100
95636464

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C6H13O9P/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h1,3-6,8-11H,2H2,(H2,12,13,14)/t3-,4+,5+,6+/m0/s1/i1T
C6H12TO9P262.14391100
95641033

Charge

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C6H13O9P/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h1,3-6,8-11H,2H2,(H2,12,13,14)/p-1
C6H12O9P259.12841100
19951150

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C6H13O9P/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h1,3-6,8-11H,2H2,(H2,12,13,14)/p-2/t3-,4+,5-,6+/m0/s1
C6H11O9P258.1211141
10627850

Charge

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C6H13O9P/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h1,3-6,8-11H,2H2,(H2,12,13,14)/p-2
C6H11O9P258.1211299111
4573771

1 of 4 defined stereocentres - 1/4 defined
InChI=1/C6H13O9P/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h1,3-6,8-11H,2H2,(H2,12,13,14)/t3?,4-,5?,6?/m1/s1
C6H13O9P260.13581100

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