Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C21H21N3O9 |
Molecular Weight | 459.4061 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@@]12CC3=C(C=CC(O)=C3C(=O)C1=C(O)[C@]4(O)C(=O)C(C(N)=O)=C(O)[C@@H](N(C)C)[C@]4([H])C2)[N+]([O-])=O
InChI
InChIKey=PHMPSHIUYYLXKR-UVPAEMEASA-N
InChI=1S/C21H21N3O9/c1-23(2)15-9-6-7-5-8-10(24(32)33)3-4-11(25)13(8)16(26)12(7)18(28)21(9,31)19(29)14(17(15)27)20(22)30/h3-4,7,9,15,25,27-28,31H,5-6H2,1-2H3,(H2,22,30)/t7-,9-,15-,21-/m0/s1
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C1595
Created by
admin on Fri Dec 15 16:32:29 GMT 2023 , Edited by admin on Fri Dec 15 16:32:29 GMT 2023
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SUB09323MIG
Created by
admin on Fri Dec 15 16:32:29 GMT 2023 , Edited by admin on Fri Dec 15 16:32:29 GMT 2023
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C76992
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admin on Fri Dec 15 16:32:29 GMT 2023 , Edited by admin on Fri Dec 15 16:32:29 GMT 2023
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1725
Created by
admin on Fri Dec 15 16:32:29 GMT 2023 , Edited by admin on Fri Dec 15 16:32:29 GMT 2023
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100000084121
Created by
admin on Fri Dec 15 16:32:29 GMT 2023 , Edited by admin on Fri Dec 15 16:32:29 GMT 2023
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DTXSID601023982
Created by
admin on Fri Dec 15 16:32:29 GMT 2023 , Edited by admin on Fri Dec 15 16:32:29 GMT 2023
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5585-59-1
Created by
admin on Fri Dec 15 16:32:29 GMT 2023 , Edited by admin on Fri Dec 15 16:32:29 GMT 2023
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CHEMBL2107132
Created by
admin on Fri Dec 15 16:32:29 GMT 2023 , Edited by admin on Fri Dec 15 16:32:29 GMT 2023
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2JH9LR1Y6S
Created by
admin on Fri Dec 15 16:32:29 GMT 2023 , Edited by admin on Fri Dec 15 16:32:29 GMT 2023
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PRIMARY |
ACTIVE MOIETY