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 15 results

Search term: PTVXQARCLQPGIR (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
58841

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C6H13O8P/c1-2-3(7)4(8)5(9)6(13-2)14-15(10,11)12/h2-9H,1H3,(H2,10,11,12)/t2-,3+,4+,5-,6+/m0/s1
C6H13O8P244.1364333800
388911

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C6H13O8P/c1-2-3(7)4(8)5(9)6(13-2)14-15(10,11)12/h2-9H,1H3,(H2,10,11,12)/t2-,3+,4+,5-,6?/m0/s1
C6H13O8P244.1364192000
388514

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C6H13O8P/c1-2-3(7)4(8)5(9)6(13-2)14-15(10,11)12/h2-9H,1H3,(H2,10,11,12)/t2-,3+,4+,5-,6-/m0/s1
C6H13O8P244.136491100
25058279

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C6H13O8P/c1-2-3(7)4(8)5(9)6(13-2)14-15(10,11)12/h2-9H,1H3,(H2,10,11,12)/t2-,3-,4+,5+,6-/m0/s1
C6H13O8P244.13644400
26330670

Charge

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C6H13O8P/c1-2-3(7)4(8)5(9)6(13-2)14-15(10,11)12/h2-9H,1H3,(H2,10,11,12)/p-2/t2-,3+,4+,5-,6+/m0/s1
C6H11O8P242.12163300
9819160

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C6H13O8P/c1-2-3(7)4(8)5(9)6(13-2)14-15(10,11)12/h2-9H,1H3,(H2,10,11,12)/t2-,3-,4+,5+,6?/m1/s1
C6H13O8P244.13643200
9689067

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C6H13O8P/c1-2-3(7)4(8)5(9)6(13-2)14-15(10,11)12/h2-9H,1H3,(H2,10,11,12)/t2-,3-,4+,5-,6?/m1/s1
C6H13O8P244.13642100
110464094

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C6H13O8P/c1-2-3(7)4(8)5(9)6(13-2)14-15(10,11)12/h2-9H,1H3,(H2,10,11,12)/t2?,3-,4+,5?,6+/m1/s1
C6H13O8P244.13641100
114454219

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C6H13O8P/c1-2-3(7)4(8)5(9)6(13-2)14-15(10,11)12/h2-9H,1H3,(H2,10,11,12)/t2?,3-,4+,5?,6-/m1/s1
C6H13O8P244.13641100
9972309

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C6H13O8P/c1-2-3(7)4(8)5(9)6(13-2)14-15(10,11)12/h2-9H,1H3,(H2,10,11,12)/t2-,3-,4+,5+,6+/m0/s1
C6H13O8P244.13641100
24785461

Charge

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C6H13O8P/c1-2-3(7)4(8)5(9)6(13-2)14-15(10,11)12/h2-9H,1H3,(H2,10,11,12)/p-2
C6H11O8P242.12161100

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