Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C27H30N4O4.C2H4O3 |
| Molecular Weight | 550.6029 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OCC(O)=O.CC(C)(CC1=CC=C(OC2=NC=C(C=C2)C(N)=O)C=C1)NC[C@H](O)COC3=C4C=CNC4=CC=C3
InChI
InChIKey=JDQMRAJJRYCERQ-BDQAORGHSA-N
InChI=1S/C27H30N4O4.C2H4O3/c1-27(2,31-16-20(32)17-34-24-5-3-4-23-22(24)12-13-29-23)14-18-6-9-21(10-7-18)35-25-11-8-19(15-30-25)26(28)33;3-1-2(4)5/h3-13,15,20,29,31-32H,14,16-17H2,1-2H3,(H2,28,33);3H,1H2,(H,4,5)/t20-;/m0./s1
| Molecular Formula | C2H4O3 |
| Molecular Weight | 76.0514 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C27H30N4O4 |
| Molecular Weight | 474.5515 |
| 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
Fri Dec 16 20:35:43 UTC 2022
by
admin
on
Fri Dec 16 20:35:43 UTC 2022
|
| Record UNII |
8RH45G4F5T
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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| Code System | Code | Type | Description | ||
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8RH45G4F5T
Created by
admin on Fri Dec 16 20:35:43 UTC 2022 , Edited by admin on Fri Dec 16 20:35:43 UTC 2022
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PRIMARY | |||
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9829004
Created by
admin on Fri Dec 16 20:35:43 UTC 2022 , Edited by admin on Fri Dec 16 20:35:43 UTC 2022
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340784-55-6
Created by
admin on Fri Dec 16 20:35:43 UTC 2022 , Edited by admin on Fri Dec 16 20:35:43 UTC 2022
|
PRIMARY |
| Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE | |||
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PARENT -> SALT/SOLVATE |
| Related Record | Type | Details | ||
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ACTIVE MOIETY |