Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C17H22N4O12P2 |
| Molecular Weight | 536.3237 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=CC2=C(C=C1C)N(C[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)OP(O)(O)=O)C3=NC(=O)NC(=O)C3=N2
InChI
InChIKey=NROVZJTZFFUDOZ-SCRDCRAPSA-N
InChI=1S/C17H22N4O12P2/c1-7-3-9-10(4-8(7)2)21(15-13(18-9)16(24)20-17(25)19-15)5-11(22)14(23)12(33-35(29,30)31)6-32-34(26,27)28/h3-4,11-12,14,22-23H,5-6H2,1-2H3,(H,20,24,25)(H2,26,27,28)(H2,29,30,31)/t11-,12+,14-/m0/s1
| Molecular Formula | C17H22N4O12P2 |
| Molecular Weight | 536.3237 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 15:11:04 UTC 2023
by
admin
on
Sat Dec 16 15:11:04 UTC 2023
|
| Record UNII |
9I85AB6YHA
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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| Code System | Code | Type | Description | ||
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102008490
Created by
admin on Sat Dec 16 15:11:04 UTC 2023 , Edited by admin on Sat Dec 16 15:11:04 UTC 2023
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PRIMARY | |||
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86108-25-0
Created by
admin on Sat Dec 16 15:11:04 UTC 2023 , Edited by admin on Sat Dec 16 15:11:04 UTC 2023
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PRIMARY | |||
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9I85AB6YHA
Created by
admin on Sat Dec 16 15:11:04 UTC 2023 , Edited by admin on Sat Dec 16 15:11:04 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> IMPURITY |
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PARENT -> IMPURITY |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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