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 5 results

Search term: DPFMDQHSXXGXIS (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
17131169

Double-bond stereo

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C31H39N5O5/c1-20(33-30(38)31-16-22-11-23(17-31)13-24(12-22)18-31)29(37)34-32-19-26-6-5-25(28(26)35-7-9-41-10-8-35)14-21-3-2-4-27(15-21)36(39)40/h2-4,14-15,19-20,22-24H,5-13,16-18H2,1H3,(H,33,38)(H,34,37)/b25-14-,32-19+
C31H39N5O5561.67198600
64186178

Double-bond stereo

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C31H39N5O5/c1-20(33-30(38)31-16-22-11-23(17-31)13-24(12-22)18-31)29(37)34-32-19-26-6-5-25(28(26)35-7-9-41-10-8-35)14-21-3-2-4-27(15-21)36(39)40/h2-4,14-15,19-20,22-24H,5-13,16-18H2,1H3,(H,33,38)(H,34,37)/b25-14u,32-19+
C31H39N5O5561.67193500
34433201

Double-bond stereo

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C31H39N5O5/c1-20(33-30(38)31-16-22-11-23(17-31)13-24(12-22)18-31)29(37)34-32-19-26-6-5-25(28(26)35-7-9-41-10-8-35)14-21-3-2-4-27(15-21)36(39)40/h2-4,14-15,19-20,22-24H,5-13,16-18H2,1H3,(H,33,38)(H,34,37)/b25-14+,32-19+
C31H39N5O5561.67192100
3430031

Double-bond stereo

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C31H39N5O5/c1-20(33-30(38)31-16-22-11-23(17-31)13-24(12-22)18-31)29(37)34-32-19-26-6-5-25(28(26)35-7-9-41-10-8-35)14-21-3-2-4-27(15-21)36(39)40/h2-4,14-15,19-20,22-24H,5-13,16-18H2,1H3,(H,33,38)(H,34,37)
C31H39N5O5561.6718599999982100
13087275

Double-bond stereo

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C31H39N5O5/c1-20(33-30(38)31-16-22-11-23(17-31)13-24(12-22)18-31)29(37)34-32-19-26-6-5-25(28(26)35-7-9-41-10-8-35)14-21-3-2-4-27(15-21)36(39)40/h2-4,14-15,19-20,22-24H,5-13,16-18H2,1H3,(H,33,38)(H,34,37)/b25-14-,32-19u
C31H39N5O5561.67191100

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