Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C20H25N7O6.2C6H13NO5 |
Molecular Weight | 817.798 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 10 / 10 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO.N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO.CN1[C@@H](CNC2=CC=C(C=C2)C(=O)N[C@@H](CCC(O)=O)C(O)=O)CNC3=C1C(=O)NC(N)=N3
InChI
InChIKey=FZDRYCKUVGVDSO-KWWXADPNSA-N
InChI=1S/C20H25N7O6.2C6H13NO5/c1-27-12(9-23-16-15(27)18(31)26-20(21)25-16)8-22-11-4-2-10(3-5-11)17(30)24-13(19(32)33)6-7-14(28)29;2*7-3(1-8)5(11)6(12)4(10)2-9/h2-5,12-13,22H,6-9H2,1H3,(H,24,30)(H,28,29)(H,32,33)(H4,21,23,25,26,31);2*1,3-6,9-12H,2,7H2/t12-,13-;2*3-,4+,5+,6+/m000/s1
Molecular Formula | C6H13NO5 |
Molecular Weight | 179.1711 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C20H25N7O6 |
Molecular Weight | 459.4558 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 10:08:12 UTC 2023
by
admin
on
Sat Dec 16 10:08:12 UTC 2023
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Record UNII |
Q65PL71Q1A
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Record Status |
Validated (UNII)
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Record Version |
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-
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Q65PL71Q1A
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100000174527
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DBSALT001567
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1592256
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DTXSID101019760
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Q65PL71Q1A
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135565261
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1181972-37-1
Created by
admin on Sat Dec 16 10:08:12 UTC 2023 , Edited by admin on Sat Dec 16 10:08:12 UTC 2023
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE | |||
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PARENT -> SALT/SOLVATE |
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ACTIVE MOIETY |