Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C21H31N7O.C4H6O6 |
Molecular Weight | 547.604 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O[C@H]([C@@H](O)C(O)=O)C(O)=O.CC[C@H](NC1=NC2=C(N=CN2C(C)C)C(NCC3=CN=C(C)C=C3C)=N1)[C@@H](C)O
InChI
InChIKey=WESMSPXMIVOLQU-JLJSJTGXSA-N
InChI=1S/C21H31N7O.C4H6O6/c1-7-17(15(6)29)25-21-26-19(18-20(27-21)28(11-24-18)12(2)3)23-10-16-9-22-14(5)8-13(16)4;5-1(3(7)8)2(6)4(9)10/h8-9,11-12,15,17,29H,7,10H2,1-6H3,(H2,23,25,26,27);1-2,5-6H,(H,7,8)(H,9,10)/t15-,17+;1-,2-/m11/s1
Approval Year
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Preferred Name | English | ||
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Systematic Name | English | ||
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Common Name | English |
Code System | Code | Type | Description | ||
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53302368
Created by
admin on Sat Dec 16 09:41:23 UTC 2023 , Edited by admin on Sat Dec 16 09:41:23 UTC 2023
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PRIMARY | |||
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300000022091
Created by
admin on Sat Dec 16 09:41:23 UTC 2023 , Edited by admin on Sat Dec 16 09:41:23 UTC 2023
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PRIMARY | |||
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1315571-33-5
Created by
admin on Sat Dec 16 09:41:23 UTC 2023 , Edited by admin on Sat Dec 16 09:41:23 UTC 2023
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PRIMARY | |||
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7X248KO684
Created by
admin on Sat Dec 16 09:41:23 UTC 2023 , Edited by admin on Sat Dec 16 09:41:23 UTC 2023
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PRIMARY |
ACTIVE MOIETY
SUBSTANCE RECORD