Details
Stereochemistry | ABSOLUTE |
Molecular Formula | 2C18H23N5O8P.Ba |
Molecular Weight | 1074.082 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 8 / 8 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Ba++].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=SGRJEVOMCAWIMW-NGVPHMJWSA-L
InChI=1S/2C18H24N5O8P.Ba/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
Approval Year
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Code System | Code | Type | Description | ||
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m2743
Created by
admin on Sat Dec 16 09:04:57 GMT 2023 , Edited by admin on Sat Dec 16 09:04:57 GMT 2023
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PRIMARY | Merck Index | ||
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72941524
Created by
admin on Sat Dec 16 09:04:57 GMT 2023 , Edited by admin on Sat Dec 16 09:04:57 GMT 2023
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PRIMARY | |||
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18837-96-2
Created by
admin on Sat Dec 16 09:04:57 GMT 2023 , Edited by admin on Sat Dec 16 09:04:57 GMT 2023
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PRIMARY | |||
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2ZC4ZS8T1A
Created by
admin on Sat Dec 16 09:04:57 GMT 2023 , Edited by admin on Sat Dec 16 09:04:57 GMT 2023
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PRIMARY |
SUBSTANCE RECORD