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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
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Found 12 results

Search term: C40H77NO3 (Found by molecular formula)
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
24765767

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C40H77NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-36-40(44)41-38(37-42)39(43)35-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h17-18,33,35,38-39,42-43H,3-16,19-32,34,36-37H2,1-2H3,(H,41,44)/b18-17-,35-33+/t38-,39+/m0/s1
C40H77NO3620.04436700
64808485

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C40H77NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-36-40(44)41-38(37-42)39(43)35-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h8,10,33,35,38-39,42-43H,3-7,9,11-32,34,36-37H2,1-2H3,(H,41,44)/b10-8-,35-33+/t38-,39+/m0/s1
C40H77NO3620.04433400
81407819

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C40H77NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-36-40(44)41-38(37-42)39(43)35-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h8,10,17-18,38-39,42-43H,3-7,9,11-16,19-37H2,1-2H3,(H,41,44)/b10-8-,18-17-/t38-,39+/m0/s1
C40H77NO3620.04433300
95718522

Double-bond stereo
InChI=1/C40H77NO3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-37-41-39(42)35-36-40(43)44-38-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-36H,3-34,37-38H2,1-2H3,(H,41,42)/b36-35+
C40H77NO3620.04432300
28673936

Double-bond stereo
InChI=1/C40H77NO3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-37-41-39(42)35-36-40(43)44-38-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-36H,3-34,37-38H2,1-2H3,(H,41,42)
C40H77NO3620.04432100
8921770

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C40H77NO3/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-23-24-26-28-30-32-34-36-40(44)41-38(37-42)39(43)35-33-31-29-27-25-14-12-10-8-6-4-2/h16-17,33,35,38-39,42-43H,3-15,18-32,34,36-37H2,1-2H3,(H,41,44)/b17-16+,35-33+/t38-,39+/m0/s1
C40H77NO3620.04432100
9597077

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C40H77NO3/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-38-41-40(3,36-43-38)37-44-39(42)35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h4-37H2,1-3H3
C40H77NO3620.04432100
57344528
InChI=1/C40H77NO3/c1-4-7-10-13-16-19-22-25-28-31-38(42)34-36-41(40(44)33-30-27-24-21-18-15-12-9-6-3)37-35-39(43)32-29-26-23-20-17-14-11-8-5-2/h4-37H2,1-3H3
C40H77NO3620.04431100
57520562

Double-bond stereo
InChI=1/C40H77NO3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-37-41-39(42)35-36-40(43)44-38-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-36H,3-34,37-38H2,1-2H3,(H,41,42)/b36-35-
C40H77NO3620.04431100
57560866

Double-bond stereo
InChI=1/C40H77NO3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-37-41(39(42)35-36-40(43)44)38-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-36H,3-34,37-38H2,1-2H3,(H,43,44)
C40H77NO3620.04431100
59699916

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C40H77NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-36-40(44)41-38(37-42)39(43)35-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h17-18,33,35,38-39,42-43H,3-16,19-32,34,36-37H2,1-2H3,(H,41,44)/b18-17+,35-33+/t38-,39+/m0/s1
C40H77NO3620.04431100
113381123

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C40H77NO3/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-23-24-26-28-30-32-34-36-40(44)41-38(37-42)39(43)35-33-31-29-27-25-14-12-10-8-6-4-2/h29,31,33,35,38-39,42-43H,3-28,30,32,34,36-37H2,1-2H3,(H,41,44)/b31-29+,35-33+/t38-,39+/m0/s1
C40H77NO3620.04431100

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