Molecule FYI-1006259

A

Molecule Summary:

ID: FYI-1006259
Names:
InChIKey: FQZTUKMFVLQPRV-UHFFFAOYSA-N
SMILES: COc5ccc4[nH]c2c(CCN3CC1CC(OC)OCC1CC23)c4c5

Received at FYIcenter.com on: 2023-12-06

Molecule ID: FYI-1006259 Edit

Molecule Structure InChIKey: FQZTUKMFVLQPRV-UHFFFAOYSA-N

Molecule Structure SMILES String: COc5ccc4[nH]c2c(CCN3CC1CC(OC)OCC1CC23)c4c5

Download SDF Download SVG Structure in 2D SDF:

FYI-1006259
FYIcenter.com

 25 29  0  0  0  0  0  0  0  0999 V2000
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 24  9  1  0  0  0  0
 24  6  1  0  0  0  0
 25 24  2  0  0  0  0
 25  3  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1006259-3D
FYIcenter.com

 51 55  0  0  1  0  0  0  0  0999 V2000
    1.0557   -0.7235   -0.0781 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3252   -0.1180    0.0874 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9172   -0.2411    1.3109 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7171   -1.2417    2.2573 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5088   -1.3230    3.4296 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5104   -0.3494    3.6184 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5349   -0.2033    4.5635 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.2744    0.9028    4.2353 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5781    1.5770    3.2512 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0430    2.9109    2.7917 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7011    3.6857    3.9755 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.3950    3.8592    3.6012 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.1352    3.8401    0.1710 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5823    2.0414    2.1390 O   0  0  0  0  0  0  0  0  0  0  0  0
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    4.6173    0.7165    2.7262 C   0  0  0  0  0  0  0  0  0  0  0  0
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 25 51  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2023-12-14, 1323👍, 0💬