Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | 2C18H23N5O8P.Ca |
| Molecular Weight | 976.833 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 8 / 8 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Ca++].CCCC(=O)NC1=NC=NC2=C1N=CN2[C@@H]3O[C@@H]4COP([O-])(=O)O[C@H]4[C@H]3OC(=O)CCC.CCCC(=O)NC5=NC=NC6=C5N=CN6[C@@H]7O[C@@H]8COP([O-])(=O)O[C@H]8[C@H]7OC(=O)CCC
InChI
InChIKey=RCFZVVHQICKFQW-NGVPHMJWSA-L
InChI=1S/2C18H24N5O8P.Ca/c2*1-3-5-11(24)22-16-13-17(20-8-19-16)23(9-21-13)18-15(30-12(25)6-4-2)14-10(29-18)7-28-32(26,27)31-14;/h2*8-10,14-15,18H,3-7H2,1-2H3,(H,26,27)(H,19,20,22,24);/q;;+2/p-2/t2*10-,14-,15-,18-;/m11./s1
| Molecular Formula | C18H23N5O8P |
| Molecular Weight | 468.3777 |
| Charge | -1 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | Ca |
| Molecular Weight | 40.078 |
| Charge | 2 |
| 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
Sat Dec 16 15:42:00 UTC 2023
by
admin
on
Sat Dec 16 15:42:00 UTC 2023
|
| Record UNII |
7J3JCE9A9U
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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7J3JCE9A9U
Created by
admin on Sat Dec 16 15:42:01 UTC 2023 , Edited by admin on Sat Dec 16 15:42:01 UTC 2023
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44514776
Created by
admin on Sat Dec 16 15:42:01 UTC 2023 , Edited by admin on Sat Dec 16 15:42:01 UTC 2023
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100000172823
Created by
admin on Sat Dec 16 15:42:01 UTC 2023 , Edited by admin on Sat Dec 16 15:42:01 UTC 2023
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938448-87-4
Created by
admin on Sat Dec 16 15:42:01 UTC 2023 , Edited by admin on Sat Dec 16 15:42:01 UTC 2023
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
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