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 46 results

Search term: VQHSOMBJVWLPSR (Found by InChIKey (skeleton match))
123
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
432001


9 of 9 defined stereocentres - 9/9 defined
InChI=1/C12H24O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h4-21H,1-3H2/t4-,5+,6+,7+,8+,9-,10+,11+,12+/m0/s1
C12H24O11344.31247923695
138481

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C12H24O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h4-21H,1-3H2/t4-,5+,6+,7+,8-,9-,10+,11+,12-/m0/s1
C12H24O11344.3124748988
141050

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C12H24O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h4-21H,1-3H2/t4-,5+,6+,7+,8+,9-,10+,11+,12-/m0/s1
C12H24O11344.3124262200
3736

0 of 9 defined stereocentres - 0/9 defined
InChI=1/C12H24O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h4-21H,1-3H2
C12H24O11344.31241722800
17345172

8 of 9 defined stereocentres - 8/9 defined
InChI=1/C12H24O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h4-21H,1-3H2/t4-,5?,6+,7+,8+,9-,10+,11+,12+/m0/s1
C12H24O11344.31249600
5506086

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C12H24O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h4-21H,1-3H2/t4-,5+,6-,7-,8+,9+,10-,11-,12+/m1/s1
C12H24O11344.31245300
5473770

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C12H24O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h4-21H,1-3H2/t4-,5-,6-,7-,8+,9+,10-,11-,12+/m1/s1
C12H24O11344.31245400
82601

8 of 9 defined stereocentres - 8/9 defined
InChI=1/C12H24O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h4-21H,1-3H2/t4-,5+,6+,7+,8-,9?,10+,11+,12-/m0/s1
C12H24O11344.31244400
5885125

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C12H24O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h4-21H,1-3H2/t4-,5+,6+,7+,8+,9-,10+,11-,12+/m0/s1
C12H24O11344.31244200
8060208

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C12H24O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h4-21H,1-3H2/t4-,5+,6-,7+,8+,9+,10-,11-,12+/m1/s1
C12H24O11344.31244300
58841219

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C12H24O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h4-21H,1-3H2/t4-,5+,6+,7+,8-,9-,10+,11-,12-/m0/s1
C12H24O11344.31243300
62987818

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C12H24O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h4-21H,1-3H2/t4-,5+,6-,7-,8-,9+,10-,11-,12+/m1/s1
C12H24O11344.31243200
5506084

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C12H24O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h4-21H,1-3H2/t4-,5+,6-,7-,8+,9+,10-,11+,12+/m1/s1
C12H24O11344.31243100
8060209

8 of 9 defined stereocentres - 8/9 defined
InChI=1/C12H24O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h4-21H,1-3H2/t4-,5-,6+,7+,8-,9-,10+,11?,12-/m0/s1
C12H24O11344.31242100
9188570

9 of 9 defined stereocentres - 9/9 defined

Non-standard isotope
InChI=1/C12H24O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h4-21H,1-3H2/t4-,5+,6+,7+,8+,9-,10+,11+,12-/m0/s1/i1D/t1?,4-,5+,6+,7+,8+,9-,10+,11+,12-
C12H23DO11345.31852200
26563730

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C12H24O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h4-21H,1-3H2/t4-,5-,6+,7+,8-,9-,10+,11-,12-/m1/s1
C12H24O11344.31242100
26646873

8 of 9 defined stereocentres - 8/9 defined
InChI=1/C12H24O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h4-21H,1-3H2/t4-,5+,6-,7+,8-,9-,10+,11?,12-/m0/s1
C12H24O11344.31242200
58785588

7 of 9 defined stereocentres - 7/9 defined
InChI=1/C12H24O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h4-21H,1-3H2/t4-,5+,6?,7+,8-,9?,10-,11+,12-/m0/s1
C12H24O11344.31242200
5506082

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C12H24O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h4-21H,1-3H2/t4-,5-,6-,7-,8+,9+,10-,11+,12+/m1/s1
C12H24O11344.31242100
2015906

5 of 9 defined stereocentres - 5/9 defined
InChI=1/C12H24O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h4-21H,1-3H2/t4?,5?,6-,7?,8+,9+,10-,11?,12+/m1/s1
C12H24O11344.312362100
123

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