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(NC2=NC=NN3C=CC(CN4CC[C@@H](N)[C@H](O)C4)=C23)=CC=C1O[C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)C(O)=O
InChI
InChIKey=FFFMNQAJPFIMMO-TYVPUJLBSA-N
InChI=1S/C25H32N6O9/c1-38-17-8-13(2-3-16(17)39-25-21(35)19(33)20(34)22(40-25)24(36)37)29-23-18-12(4-7-31(18)28-11-27-23)9-30-6-5-14(26)15(32)10-30/h2-4,7-8,11,14-15,19-22,25,32-35H,5-6,9-10,26H2,1H3,(H,36,37)(H,27,28,29)/t14-,15-,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
Sat Dec 16 14:38:59 UTC 2023
by
admin
on
Sat Dec 16 14:38:59 UTC 2023
|
| Record UNII |
BN26AHX3YV
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
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Systematic Name | English | ||
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Common Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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BN26AHX3YV
Created by
admin on Sat Dec 16 14:39:00 UTC 2023 , Edited by admin on Sat Dec 16 14:39:00 UTC 2023
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PRIMARY | |||
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156596425
Created by
admin on Sat Dec 16 14:39:00 UTC 2023 , Edited by admin on Sat Dec 16 14:39:00 UTC 2023
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1248590-54-6
Created by
admin on Sat Dec 16 14:39:00 UTC 2023 , Edited by admin on Sat Dec 16 14:39:00 UTC 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE |
URINE
|
