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Items: 1 to 20 of 250

1.
an image of a chemical structure CID 135925275

(R,R,R)-Aprepitant; 1148113-53-4; (1R,2R,3R)-Aprepitant ...

MW:
534.400
g/mol
MF:
C23H21F7N4O3
IUPAC name:
3-[[(2R,3R)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy...
Create Date:
2019-01-19
CID:
135925275

Summary Same Parent, Connectivity

2.
an image of a chemical structure CID 135536164

[2-[1-[5,7-dihydroxy-3-(3,4,5-trihydroxybenzoyl)oxy-3,4-dihydro-2H-chromen-2-yl]-3,4,5-trihydroxy-6-oxobenzo[7]annulen-8-yl]-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate; Theaflavine-3,3'-digallate; CHEMBL1451483 ...

MW:
868.700
g/mol
MF:
C43H32O20
IUPAC name:
[2-[1-[5,7-dihydroxy-3-(3,4,5-trihydroxybenzoyl)oxy-3,4-dihy...
Create Date:
2019-01-15
CID:
135536164

Summary Same Parent, Connectivity

3.
an image of a chemical structure CID 135438671

3,4,5-trihydroxy-1,8-bis(3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl)benzo[7]annulen-6-one; Isotheaflavin; 3,4,6-trihydroxy-1,8-bis(3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl)benzo[7]annulen-5-one ...

MW:
564.500
g/mol
MF:
C29H24O12
IUPAC name:
3,4,6-trihydroxy-1,8-bis(3,5,7-trihydroxy-3,4-dihydro-2H-chr...
Create Date:
2019-01-15
CID:
135438671

Summary Same Parent, Connectivity

4.
an image of a chemical structure CID 73265188

NCGC00159460-02; CHEMBL3348820

MW:
711.900
g/mol
MF:
C36H49N5O8S
IUPAC name:
(2R)-1-[(2S,4R)-4-benzyl-2-hydroxy-5-[[(1S,2R)-2-hydroxy-2,3...
Create Date:
2014-03-21
CID:
73265188

Summary Same Parent, ConnectivityMixture/Component Compounds

5.
an image of a chemical structure CID 60196341

DTXSID5048631; Mecobalamin; methylcobalamin ...

MW:
1344.400
g/mol
MF:
C63H91CoN13O14P
IUPAC name:
carbanide;cobalt(3+);[5-(5,6-dimethylbenzimidazol-1-yl)-4-hy...
Create Date:
2012-10-06
CID:
60196341

Summary Same Parent, ConnectivityMixture/Component CompoundsPubMed (MeSH Keyword)

6.
an image of a chemical structure CID 60196309

DTXSID8046901; Hydroxocobalamin acetate; DTXCID6026901 ...

MW:
1390.400
g/mol
MF:
C64H93CoN13O16P-
IUPAC name:
acetic acid;cobalt;[(2R,3S,4R,5S)-5-(5,6-dimethylbenzimidazo...
Create Date:
2012-10-06
CID:
60196309

Summary Same Parent, ConnectivityMixture/Component Compounds

7.
an image of a chemical structure CID 54680085

Bromadiolone; 28772-56-7; Broprodifacoum ...

MW:
527.400
g/mol
MF:
C30H23BrO4
IUPAC name:
3-[3-[4-(4-bromophenyl)phenyl]-3-hydroxy-1-phenylpropyl]-4-h...
Create Date:
2011-12-26
CID:
54680085

Summary Same Parent, ConnectivityPubMed (MeSH Keyword)

8.
an image of a chemical structure CID 53315746

CHEMBL1902543; NCGC00188163-01

MW:
485.400
g/mol
MF:
C25H30IN2+
IUPAC name:
N,N-diethyl-2-[(E)-2-[4-(4-iodobutyl)quinolin-1-ium-1-yl]eth...
Create Date:
2011-08-19
CID:
53315746

Summary Same Parent, Connectivity

9.
an image of a chemical structure CID 53315649

CHEMBL2361368; NCGC00187354-01

MW:
303.400
g/mol
MF:
C21H21NO
IUPAC name:
(1S)-11-[(3-methylphenyl)methyl]-11-azatricyclo[7.4.1.05,14]...
Create Date:
2011-08-19
CID:
53315649

Summary Same Parent, Connectivity

10.
an image of a chemical structure CID 53315243

CHEMBL1875125; ZINC36381183; NCGC00184449-01 ...

MW:
303.400
g/mol
MF:
C21H23N2+
IUPAC name:
ethyl-dimethyl-[4-[(E)-2-quinolin-4-ylethenyl]phenyl]azanium
Create Date:
2011-08-19
CID:
53315243

Summary Same Parent, Connectivity

11.
an image of a chemical structure CID 45167089

CHEMBL2358412; NCGC00240319-01

MW:
491.600
g/mol
MF:
C27H29N3O4S
IUPAC name:
1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(2-thioph...
Create Date:
2010-04-27
CID:
45167089

Summary Same Parent, Connectivity

12.
an image of a chemical structure CID 45166541

NCGC00239769-01

MW:
398.400
g/mol
MF:
C21H20F2N4O2
IUPAC name:
N-[[5-fluoro-7-(4-fluoro-3-methylphenyl)-2,3-dihydro-1-benzo...
Create Date:
2010-04-27
CID:
45166541

Summary Same Parent, Connectivity

13.
an image of a chemical structure CID 45166278

CHEMBL2138776; NCGC00239534-01

MW:
407.600
g/mol
MF:
C23H29N5S
IUPAC name:
2-[1-[[4-(azepan-1-yl)quinazolin-2-yl]methyl]piperidin-2-yl]...
Create Date:
2010-04-27
CID:
45166278

Summary Same Parent, Connectivity

14.
an image of a chemical structure CID 45166182

CHEMBL2356864; NCGC00239440-01

MW:
448.400
g/mol
MF:
C23H23F3N2O4
IUPAC name:
(2S)-1-acetyl-N-[[5-[3-(trifluoromethoxy)phenyl]-2,3-dihydro...
Create Date:
2010-04-27
CID:
45166182

Summary Same Parent, Connectivity

15.
an image of a chemical structure CID 45165572

CHEMBL1990128; NCGC00238841-01

MW:
407.400
g/mol
MF:
C22H18FN3O4
IUPAC name:
methyl 4-[(5-fluoro-7-pyrimidin-5-yl-2,3-dihydro-1-benzofura...
Create Date:
2010-04-27
CID:
45165572

Summary Same Parent, Connectivity

16.
an image of a chemical structure CID 44142211

MLS002297889; CHEMBL1731640; HMS2194J21 ...

MW:
440.500
g/mol
MF:
C28H28N2O3
IUPAC name:
ethyl (6aR,11aS)-6-benzyl-9-(dimethylamino)-5-oxo-6a,11-dihy...
Create Date:
2009-08-18
CID:
44142211

Summary Same Parent, Connectivity

17.
an image of a chemical structure CID 44142204

MLS002297881; CHEMBL1733566; HMS2195N22 ...

MW:
403.500
g/mol
MF:
C24H21NO3S
IUPAC name:
ethyl (1S,10S)-9-benzyl-8-oxo-12-thia-9-azatetracyclo[8.6.0....
Create Date:
2009-08-18
CID:
44142204

Summary Same Parent, Connectivity

18.
an image of a chemical structure CID 44142181

MLS002297857; CHEMBL1868638; SCHEMBL20396151 ...

MW:
410.300
g/mol
MF:
C18H20BrNO3S
IUPAC name:
N-[(2-bromophenyl)methyl]-N-[(2S)-1-hydroxy-3-phenylpropan-2...
Create Date:
2009-08-18
CID:
44142181

Summary Same Parent, Connectivity

19.
an image of a chemical structure CID 44142174

MLS002297846; CHEMBL1903029; HMS2209P24 ...

MW:
297.400
g/mol
MF:
C15H23NO3S
IUPAC name:
N-benzyl-N-[(2S)-1-hydroxy-4-methylpentan-2-yl]ethenesulfona...
Create Date:
2009-08-18
CID:
44142174

Summary Same Parent, Connectivity

20.
an image of a chemical structure CID 42628589

MLS002222507; CHEMBL1457360; HMS2219C24 ...

MW:
390.600
g/mol
MF:
C22H34N2O2S
IUPAC name:
N-[4-[(2R)-3-[(5R)-5-tert-butyl-2-oxoazepan-1-yl]-2-methylpr...
Create Date:
2009-07-09
CID:
42628589

Summary Same Parent, Connectivity

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