Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C22H26N2O4.C2H2O4 |
| Molecular Weight | 472.4877 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)C(O)=O.COC(=O)C1=CO[C@@H](C)[C@@H]2CN3CCC4=C(NC5=C4C=C(OC)C=C5)[C@@H]3C[C@H]12
InChI
InChIKey=PAUMEXDEFPNOBG-WUXOJFDOSA-N
InChI=1S/C22H26N2O4.C2H2O4/c1-12-17-10-24-7-6-14-16-8-13(26-2)4-5-19(16)23-21(14)20(24)9-15(17)18(11-28-12)22(25)27-3;3-1(4)2(5)6/h4-5,8,11-12,15,17,20,23H,6-7,9-10H2,1-3H3;(H,3,4)(H,5,6)/t12-,15-,17-,20-;/m0./s1
| Molecular Formula | C22H26N2O4 |
| Molecular Weight | 382.4528 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | C2H2O4 |
| Molecular Weight | 90.0349 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Tue Apr 01 19:33:17 GMT 2025
by
admin
on
Tue Apr 01 19:33:17 GMT 2025
|
| Record UNII |
04BAC87S7F
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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Preferred Name | English | ||
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| Code System | Code | Type | Description | ||
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04BAC87S7F
Created by
admin on Tue Apr 01 19:33:17 GMT 2025 , Edited by admin on Tue Apr 01 19:33:17 GMT 2025
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68135-10-4
Created by
admin on Tue Apr 01 19:33:17 GMT 2025 , Edited by admin on Tue Apr 01 19:33:17 GMT 2025
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PRIMARY | |||
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123133486
Created by
admin on Tue Apr 01 19:33:17 GMT 2025 , Edited by admin on Tue Apr 01 19:33:17 GMT 2025
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PRIMARY |
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|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |