Molecule FYI-1004997

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A

Molecule Summary:

ID: FYI-1004997
Names:
InChIKey: XWIHCOMUPKBBBD-GSVOUGTGSA-N
SMILES: N[C@@H]1ONCC1=O

Received at FYIcenter.com on: 2023-10-07

Molecule ID: FYI-1004997 Edit

Molecule Structure InChIKey: XWIHCOMUPKBBBD-GSVOUGTGSA-N

Molecule Structure SMILES String: N[C@@H]1ONCC1=O

Download SDF Download SVG Structure in 2D SDF:

FYI-1004997
FYIcenter.com

  7  7  0  0  1  0  0  0  0  0999 V2000
    3.4282    3.0292    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2158    2.3292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9369    2.8986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.8582    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000    0.6458    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0695    0.9369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1098    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  6  2  1  0  0  0  0
  6  7  1  6  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1004997-3D
FYIcenter.com

 13 13  0  0  1  0  0  0  0  0999 V2000
    1.0025   -0.1294    0.1965 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4203   -0.0495   -0.1222 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.1572   -1.2123    0.2956 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0886   -0.8784    1.3860 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.3115    0.5660    1.3062 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0927    1.0731    0.6140 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7469    2.2508    0.5752 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5868   -0.8640   -0.3670 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5653    0.7498   -0.0784 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5859    0.0796   -1.1965 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9331   -1.3726    1.0930 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1865    0.7911    0.6912 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4126    1.0005    2.3019 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  8  1  0  0  0  0
  1  9  1  0  0  0  0
  2  3  1  0  0  0  0
  2  6  1  0  0  0  0
  2 10  1  6  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  4 11  1  0  0  0  0
  5  6  1  0  0  0  0
  5 12  1  0  0  0  0
  5 13  1  0  0  0  0
  6  7  2  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2023-10-15, 472👍, 0💬

Molecule FYI-1004997
Molecule Summary: ID: FYI-1004997 Names: InChIKey: XWIHCOMUPKBBBD-GSVOUGTGSA-N SMILES: N[C@@H]1ONCC1=O Received at FYIcenter.com on: 2023-10-07 2023-10-15, 474🔥, 0💬

Molecule FYI-1004995
Molecule Summary: ID: FYI-1004995 Names: InChIKey: TWSYTMMNPGUGQG-UHFFFAOYSA-N SMILES: Cn2cnc1c(=O)n(CCN)c(=O)n(C)c12 Received at FYIcenter.com on: 2023-10-07 2023-10-15, 456🔥, 0💬

Molecule FYI-1004999
Molecule Summary: ID: FYI-1004999 Names: InChIKey: GDYMBACGFUNEIQ-UHFFFAOYSA-N SMILES: O=CC(Cc1ccccc1)NC(=O)CO Received at FYIcenter.com on: 2023-10-08 2023-10-15, 430🔥, 0💬

Molecule FYI-1004992
Molecule Summary: ID: FYI-1004992 Names: InChIKey: KSMYTRLOIPBQCK-UHFFFAOYSA-M SMILES: Cc2cccc(c1cccc(C)c1S(=O)[O-])c 2OReceived at FYIcenter.com on: 2023-10-07 2023-10-15, 404🔥, 0💬

Molecule FYI-1004996
Molecule Summary: ID: FYI-1004996 Names: InChIKey: ILXAAKUDYPHVAJ-UHTFHVAVSA-N SMILES: Nc1ncnc2c1ncn2C4OC(COP(=O)(O)O P(=O)(O)OP(=O)(O)OC3CNO[C@H]3N )C(O)C4OReceived at FYIcenter.com on: 2023-10-07 2023-10-15, 393🔥, 0💬

Molecule FYI-1004993
Molecule Summary: ID: FYI-1004993 Names: InChIKey: IHAVLJAVKHCHKG-UHFFFAOYSA-N SMILES: Cc2cc(/C(N)=N/OC(=O)Nc1ccc(O)c c1)no2Received at FYIcenter.com on: 2023-10-07 2023-10-15, 355🔥, 0💬

Molecule FYI-1005000
Molecule Summary: ID: FYI-1005000 Names: InChIKey: PEMUGDMSUDYLHU-ZEQRLZLVSA-N SMILES: C=C(F)C(=O)N6CCN(c5nc(OC[C@@H] 1CCCN1C)nc4CN(c2cccc3cccc(Cl)c 23)CCc45)C[C@@H]6CC#NReceived at FYIcenter.com on: 2023-10-08 2023-10-15, 336🔥, 0💬

Molecule FYI-1004994
Molecule Summary: ID: FYI-1004994 Names: InChIKey: MZILYFGDXYIIBK-UHFFFAOYSA-N SMILES: Cc4cc(/C(N)=N/OC(=O)Nc3cc(Cn2c nc1ncnc(N)c12)c(O)c(N)c3O)no4Received at FYIcenter.com on: 2023-10-07 2023-10-15, 325🔥, 0💬

Molecule FYI-1005001
Molecule Summary: ID: FYI-1005001 Names: InChIKey: QASFUMOKHFSJGL-LAFRSMQTSA-N SMILES: CC4=C3C[C@H]2[C@@H](CC=C1C[C@@ H](O)CC[C@@]12C)[C@@H]3CC[C@]4 6O[C@@H]5C[C@H](C)CN[C@H]5[C@H ]6CReceived at FYIcenter.com on: 2023-10-09 2023-10-15, 321🔥, 0💬

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