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 12 results

Search term: MTDHILKWIRSIHB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8057288

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C6H13NO8S/c7-3-5(9)4(8)2(15-6(3)10)1-14-16(11,12)13/h2-6,8-10H,1,7H2,(H,11,12,13)/t2-,3-,4-,5-,6?/m1/s1
C6H13NO8S259.2343161500
65298

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C6H13NO8S/c7-3-5(9)4(8)2(15-6(3)10)1-14-16(11,12)13/h2-6,8-10H,1,7H2,(H,11,12,13)/t2-,3-,4-,5-,6-/m1/s1
C6H13NO8S259.23431012195
32696820

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C6H13NO8S/c7-3-5(9)4(8)2(15-6(3)10)1-14-16(11,12)13/h2-6,8-10H,1,7H2,(H,11,12,13)/t2-,3-,4+,5-,6?/m1/s1
C6H13NO8S259.23438800
35035220

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C6H13NO8S/c7-3-5(9)4(8)2(15-6(3)10)1-14-16(11,12)13/h2-6,8-10H,1,7H2,(H,11,12,13)/t2-,3-,4-,5-,6+/m1/s1
C6H13NO8S259.23434400
399504

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C6H13NO8S/c7-3-5(9)4(8)2(15-6(3)10)1-14-16(11,12)13/h2-6,8-10H,1,7H2,(H,11,12,13)
C6H13NO8S259.23434300
21233736

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C6H13NO8S/c7-3-5(9)4(8)2(15-6(3)10)1-14-16(11,12)13/h2-6,8-10H,1,7H2,(H,11,12,13)/t2-,3+,4-,5+,6-/m0/s1
C6H13NO8S259.23432100
26563594

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C6H13NO8S/c7-3-5(9)4(8)2(15-6(3)10)1-14-16(11,12)13/h2-6,8-10H,1,7H2,(H,11,12,13)/t2-,3-,4+,5+,6?/m1/s1
C6H13NO8S259.23432100
62572919

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C6H13NO8S/c7-3-5(9)4(8)2(15-6(3)10)1-14-16(11,12)13/h2-6,8-10H,1,7H2,(H,11,12,13)/t2-,3+,4-,5+,6+/m0/s1
C6H13NO8S259.23432200
62619525

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C6H13NO8S/c7-3-5(9)4(8)2(15-6(3)10)1-14-16(11,12)13/h2-6,8-10H,1,7H2,(H,11,12,13)/t2-,3-,4+,5-,6+/m1/s1
C6H13NO8S259.23432200
111309714

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C6H13NO8S/c7-3-5(9)4(8)2(15-6(3)10)1-14-16(11,12)13/h2-6,8-10H,1,7H2,(H,11,12,13)/t2-,3-,4-,5-,6?/m0/s1
C6H13NO8S259.23431100
57425800

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C6H13NO8S/c7-3-5(9)4(8)2(15-6(3)10)1-14-16(11,12)13/h2-6,8-10H,1,7H2,(H,11,12,13)/t2?,3?,4-,5?,6?/m1/s1
C6H13NO8S259.23431100
34449097

Charge

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C6H13NO8S/c7-3-5(9)4(8)2(15-6(3)10)1-14-16(11,12)13/h2-6,8-10H,1,7H2,(H,11,12,13)/p-1/t2-,3-,4-,5-,6?/m1/s1
C6H12NO8S258.22691100

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