| Properties | Image |
MNX_ID | MNXM165993 |
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reference | sabiorkM:22883 |
formula | C11H13NO7 |
global charge | 0 |
mol weight | 271.225 |
InChIKey | YPQCLGUTGDQYNI-UHFFFAOYSA-N |
InChI | InChI=1S/C11H13NO7/c13-7-5-18-11(10(15)9(7)14)19-8-4-2-1-3-6(8)12(16)17/h1-4,7,9-11,13-15H,5H2 |
SMILES | O=[N+]([O-])C1=CC=CC=C1OC1OCC(O)C(O)C1O |
MNX internals
InChI (mnx) | InChI=1/C11H13NO7/c13-7-5-18-11(10(15)9(7)14)19-8-4-2-1-3-6(8)12(16)17/h1-4,7,9-11,13-15H,5H2/t7?,9?,10?,11? |
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SMILES (mnx) | [CH:1]1=[CH:2][CH:4]=[C:8]([O:19][CH:11]2[CH:10]([OH:15])[CH:9]([OH:14])[CH:7]([OH:13])[CH2:5][O:18]2)[C:6]([N+:12]([O-:16])=[O:17])=[CH:3]1 |
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