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 9 results

Search term: TUSWQPFNQXCPGB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4444579

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C11H21NO9S2/c1-3-5(2)10(12-21-23(17,18)19)22-11-9(16)8(15)7(14)6(4-13)20-11/h5-9,11,13-16H,3-4H2,1-2H3,(H,17,18,19)/t5-,6+,7+,8-,9+,11-/m0/s1
C11H21NO9S2375.415744400
31150822

Double-bond stereo

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C11H21NO9S2/c1-3-5(2)10(12-21-23(17,18)19)22-11-9(16)8(15)7(14)6(4-13)20-11/h5-9,11,13-16H,3-4H2,1-2H3,(H,17,18,19)/t5?,6-,7-,8+,9-,11+/m1/s1
C11H21NO9S2375.41572200
58145369

Double-bond stereo

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C11H21NO9S2/c1-3-5(2)10(12-21-23(17,18)19)22-11-9(16)8(15)7(14)6(4-13)20-11/h5-9,11,13-16H,3-4H2,1-2H3,(H,17,18,19)/b12-10-/t5?,6-,7-,8+,9-,11+/m1/s1
C11H21NO9S2375.41572300
3677862

Double-bond stereo

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C11H21NO9S2/c1-3-5(2)10(12-21-23(17,18)19)22-11-9(16)8(15)7(14)6(4-13)20-11/h5-9,11,13-16H,3-4H2,1-2H3,(H,17,18,19)
C11H21NO9S2375.415742100
570911

Charge

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C11H21NO9S2/c1-3-5(2)10(12-21-23(17,18)19)22-11-9(16)8(15)7(14)6(4-13)20-11/h5-9,11,13-16H,3-4H2,1-2H3,(H,17,18,19)/p-1/t5-,6+,7+,8-,9+,11-/m0/s1
C11H20NO9S2374.40831100
3677861

Charge

Double-bond stereo

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C11H21NO9S2/c1-3-5(2)10(12-21-23(17,18)19)22-11-9(16)8(15)7(14)6(4-13)20-11/h5-9,11,13-16H,3-4H2,1-2H3,(H,17,18,19)/p-1
C11H20NO9S2374.40781100
7827564

Charge

Double-bond stereo

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C11H21NO9S2/c1-3-5(2)10(12-21-23(17,18)19)22-11-9(16)8(15)7(14)6(4-13)20-11/h5-9,11,13-16H,3-4H2,1-2H3,(H,17,18,19)/p-1/b12-10+/t5?,6-,7-,8+,9-,11+/m1/s1
C11H20NO9S2374.40831100
7827565

Double-bond stereo

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C11H21NO9S2/c1-3-5(2)10(12-21-23(17,18)19)22-11-9(16)8(15)7(14)6(4-13)20-11/h5-9,11,13-16H,3-4H2,1-2H3,(H,17,18,19)/b12-10+/t5?,6-,7-,8+,9-,11+/m1/s1
C11H21NO9S2375.41571100
21864747

Charge

Double-bond stereo

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C11H21NO9S2/c1-3-5(2)10(12-21-23(17,18)19)22-11-9(16)8(15)7(14)6(4-13)20-11/h5-9,11,13-16H,3-4H2,1-2H3,(H,17,18,19)/p-1/t5?,6-,7-,8+,9-,11+/m1/s1
C11H20NO9S2374.40831100

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