Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C25H32N6O9 |
| Molecular Weight | 560.5564 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 7 / 7 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=CC=CC(NC2=NC=NN3C(O[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)C(O)=O)=CC(CN5CC[C@@H](N)[C@H](O)C5)=C23)=C1
InChI
InChIKey=HMDYKFJJWGYYKM-MZLIMPKCSA-N
InChI=1S/C25H32N6O9/c1-38-14-4-2-3-13(8-14)29-23-18-12(9-30-6-5-15(26)16(32)10-30)7-17(31(18)28-11-27-23)39-25-21(35)19(33)20(34)22(40-25)24(36)37/h2-4,7-8,11,15-16,19-22,25,32-35H,5-6,9-10,26H2,1H3,(H,36,37)(H,27,28,29)/t15-,16-,19+,20+,21-,22+,25-/m1/s1
| Molecular Formula | C25H32N6O9 |
| Molecular Weight | 560.5564 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 7 / 7 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 00:36:35 GMT 2025
by
admin
on
Wed Apr 02 00:36:35 GMT 2025
|
| Record UNII |
KBA3K92XTT
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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Preferred Name | English | ||
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Systematic Name | English | ||
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| Code System | Code | Type | Description | ||
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156596448
Created by
admin on Wed Apr 02 00:36:35 GMT 2025 , Edited by admin on Wed Apr 02 00:36:35 GMT 2025
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KBA3K92XTT
Created by
admin on Wed Apr 02 00:36:35 GMT 2025 , Edited by admin on Wed Apr 02 00:36:35 GMT 2025
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1248590-52-4
Created by
admin on Wed Apr 02 00:36:35 GMT 2025 , Edited by admin on Wed Apr 02 00:36:35 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE |
MAJOR
PLASMA
|
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PARENT -> METABOLITE |
URINE
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