Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C14H14O3.C6H14N2O2 |
Molecular Weight | 376.4467 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
NCCCC[C@H](N)C(O)=O.COC1=CC=C2C=C(C=CC2=C1)[C@H](C)C(O)=O
InChI
InChIKey=YZESAGKBHWTAET-LMECJBHSSA-N
InChI=1S/C14H14O3.C6H14N2O2/c1-9(14(15)16)10-3-4-12-8-13(17-2)6-5-11(12)7-10;7-4-2-1-3-5(8)6(9)10/h3-9H,1-2H3,(H,15,16);5H,1-4,7-8H2,(H,9,10)/t9-;5-/m00/s1
Molecular Formula | C14H14O3 |
Molecular Weight | 230.2592 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C6H14N2O2 |
Molecular Weight | 146.1876 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 11:15:13 UTC 2023
by
admin
on
Sat Dec 16 11:15:13 UTC 2023
|
Record UNII |
15X32OGO88
|
Record Status |
Validated (UNII)
|
Record Version |
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-
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76201-68-8
Created by
admin on Sat Dec 16 11:15:13 UTC 2023 , Edited by admin on Sat Dec 16 11:15:13 UTC 2023
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SUB78149
Created by
admin on Sat Dec 16 11:15:13 UTC 2023 , Edited by admin on Sat Dec 16 11:15:13 UTC 2023
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100000138593
Created by
admin on Sat Dec 16 11:15:13 UTC 2023 , Edited by admin on Sat Dec 16 11:15:13 UTC 2023
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DTXSID40997546
Created by
admin on Sat Dec 16 11:15:13 UTC 2023 , Edited by admin on Sat Dec 16 11:15:13 UTC 2023
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15X32OGO88
Created by
admin on Sat Dec 16 11:15:13 UTC 2023 , Edited by admin on Sat Dec 16 11:15:13 UTC 2023
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156390
Created by
admin on Sat Dec 16 11:15:13 UTC 2023 , Edited by admin on Sat Dec 16 11:15:13 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |