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 10 results

Search term: KHSREFIWULNDAB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4444749

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C18H20O5/c1-9-4-3-5-11-7-12-13(18(20)23-16(12)15(9)11)8-21-14-6-10(2)17(19)22-14/h6,8-9,12,14,16H,3-5,7H2,1-2H3/b13-8+/t9-,12+,14+,16-/m0/s1
C18H20O5316.3484222000
8862222

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C18H20O5/c1-9-4-3-5-11-7-12-13(18(20)23-16(12)15(9)11)8-21-14-6-10(2)17(19)22-14/h6,8-9,12,14,16H,3-5,7H2,1-2H3/b13-8+/t9-,12+,14+,16-/m1/s1
C18H20O5316.34843200
8909510

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C18H20O5/c1-9-4-3-5-11-7-12-13(18(20)23-16(12)15(9)11)8-21-14-6-10(2)17(19)22-14/h6,8-9,12,14,16H,3-5,7H2,1-2H3/b13-8+/t9-,12-,14-,16+/m1/s1
C18H20O5316.34842100
9046085

Double-bond stereo

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C18H20O5/c1-9-4-3-5-11-7-12-13(18(20)23-16(12)15(9)11)8-21-14-6-10(2)17(19)22-14/h6,8-9,12,14,16H,3-5,7H2,1-2H3/b13-8+/t9?,12-,14-,16+/m1/s1
C18H20O5316.34842100
9144324

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C18H20O5/c1-9-4-3-5-11-7-12-13(18(20)23-16(12)15(9)11)8-21-14-6-10(2)17(19)22-14/h6,8-9,12,14,16H,3-5,7H2,1-2H3/b13-8+/t9-,12+,14-,16-/m0/s1
C18H20O5316.34842100
9209601

Double-bond stereo

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C18H20O5/c1-9-4-3-5-11-7-12-13(18(20)23-16(12)15(9)11)8-21-14-6-10(2)17(19)22-14/h6,8-9,12,14,16H,3-5,7H2,1-2H3/b13-8+/t9?,12-,14+,16+/m1/s1
C18H20O5316.34842100
4867048

Double-bond stereo

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C18H20O5/c1-9-4-3-5-11-7-12-13(18(20)23-16(12)15(9)11)8-21-14-6-10(2)17(19)22-14/h6,8-9,12,14,16H,3-5,7H2,1-2H3/b13-8+
C18H20O5316.34842200
8790681

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C18H20O5/c1-9-4-3-5-11-7-12-13(18(20)23-16(12)15(9)11)8-21-14-6-10(2)17(19)22-14/h6,8-9,12,14,16H,3-5,7H2,1-2H3/b13-8+/t9-,12-,14+,16+/m1/s1
C18H20O5316.34842100
4265018

Double-bond stereo

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C18H20O5/c1-9-4-3-5-11-7-12-13(18(20)23-16(12)15(9)11)8-21-14-6-10(2)17(19)22-14/h6,8-9,12,14,16H,3-5,7H2,1-2H3
C18H20O5316.34842100
35014834

Double-bond stereo

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C18H20O5/c1-9-4-3-5-11-7-12-13(18(20)23-16(12)15(9)11)8-21-14-6-10(2)17(19)22-14/h6,8-9,12,14,16H,3-5,7H2,1-2H3/b13-8-
C18H20O5316.34841100

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