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
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Found 8 results

Search term: IZICQJAGBLBAMJ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8272109

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C28H31NO6/c1-17(11-18(2)13-22-7-9-24(10-8-22)29(31)32)12-19(3)14-23-15-25(34-16-23)27-20(4)26(30)21(5)28(33-6)35-27/h7-14,25H,15-16H2,1-6H3/b17-11+,18-13+,19-12+,23-14-/t25-/m1/s1
C28H31NO6477.5488232400
4509000

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C28H31NO6/c1-17(11-18(2)13-22-7-9-24(10-8-22)29(31)32)12-19(3)14-23-15-25(34-16-23)27-20(4)26(30)21(5)28(33-6)35-27/h7-14,25H,15-16H2,1-6H3/b17-11+,18-13+,19-12+,23-14-
C28H31NO6477.5488141200
4903931

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C28H31NO6/c1-17(11-18(2)13-22-7-9-24(10-8-22)29(31)32)12-19(3)14-23-15-25(34-16-23)27-20(4)26(30)21(5)28(33-6)35-27/h7-14,25H,15-16H2,1-6H3/b17-11+,18-13+,19-12+,23-14+
C28H31NO6477.54887300
115040039

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C28H31NO6/c1-17(11-18(2)13-22-7-9-24(10-8-22)29(31)32)12-19(3)14-23-15-25(34-16-23)27-20(4)26(30)21(5)28(33-6)35-27/h7-14,25H,15-16H2,1-6H3/b17-11u,18-13u,19-12+,23-14u
C28H31NO6477.54883500
282347

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C28H31NO6/c1-17(11-18(2)13-22-7-9-24(10-8-22)29(31)32)12-19(3)14-23-15-25(34-16-23)27-20(4)26(30)21(5)28(33-6)35-27/h7-14,25H,15-16H2,1-6H3
C28H31NO6477.54883100
128925964

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C28H31NO6/c1-17(11-18(2)13-22-7-9-24(10-8-22)29(31)32)12-19(3)14-23-15-25(34-16-23)27-20(4)26(30)21(5)28(33-6)35-27/h7-14,25H,15-16H2,1-6H3/b17-11u,18-13u,19-12+,23-14u/t25-/m1/s1
C28H31NO6477.54881100
74041619

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C28H31NO6/c1-17(11-18(2)13-22-7-9-24(10-8-22)29(31)32)12-19(3)14-23-15-25(34-16-23)27-20(4)26(30)21(5)28(33-6)35-27/h7-14,25H,15-16H2,1-6H3/b17-11-,18-13+,19-12-,23-14-/t25-/m1/s1
C28H31NO6477.54881100
74159801

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C28H31NO6/c1-17(11-18(2)13-22-7-9-24(10-8-22)29(31)32)12-19(3)14-23-15-25(34-16-23)27-20(4)26(30)21(5)28(33-6)35-27/h7-14,25H,15-16H2,1-6H3/b17-11+,18-13+,19-12-,23-14-/t25-/m1/s1
C28H31NO6477.54881100

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