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(2Z,4E,7E)-2-hydroxy-6-oxonona-2,4,7-trienedioate
MNXM114195 is deprecated and here replaced by MNXM1371004
!!! Alternative mappings exist !!!
| Properties | Image |
MNX_ID | MNXM1371004 |
 |
reference | chebi:66888 |
formula | C9H6O6 |
global charge | -2 |
mol weight | 210.141 |
InChIKey | WCJYZUFKKTYNLB-ARITWGJRSA-L |
InChI | InChI=1S/C9H8O6/c10-6(4-5-8(12)13)2-1-3-7(11)9(14)15/h1-5,11H,(H,12,13)(H,14,15)/p-2/b2-1+,5-4+,7-3- |
SMILES | O=C([O-])/C=C/C(=O)/C=C/C=C(\O)C(=O)[O-] |
MNX internals
InChI (mnx) | InChI=1/C9H8O6/c10-6(4-5-8(12)13)2-1-3-7(11)9(14)15/h1-5,11H,(H,12,13)(H,14,15)/b2-1+,5-4+,7-3- |
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SMILES (mnx) | [CH:1](=[CH:2]/[C:6](/[CH:4]=[CH:5]/[C:8](=[O:12])[OH:13])=[O:10])\[CH:3]=[C:7](\[C:9](=[O:14])[OH:15])[OH:11] |
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Parent-child relations graph |
Occurences in reactions | #reac |
in my sandbox |
0 |
in MNXref (generic) | 2 |
in models (compartimentalized) |
2 |
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Similar chemical compounds in external resources
Identifier | Description |
CHEBI:66888 chebi:66888 WCJYZUFKKTYNLB-ARITWGJRSA-L
| (2Z,4E,7E)-2-hydroxy-6-oxonona-2,4,7-trienedioate (2Z,4E,7E)-2-hydroxy-6-oxonona-2,4,7-trienedioate(2-)
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metacyc.compound:CPD0-2184 metacycM:CPD0-2184 WCJYZUFKKTYNLB-ARITWGJRSA-L
| (2Z,4E,7E)-2-hydroxy-6-oxonona-2,4,7-triene-1,9-dioate 2-hydroxy-6-ketononatrienedioate 2-hydroxy-6-oxonona-2,4,7-triene-1,9-dioate 2-hydroxy-6-oxonona-2,4,7-triene-1,9-dioic acid 2-hydroxy-6-oxonona-2,4,7-trienedioic acid 2-hydroxy-6-oxononatrienedioate
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SLM:000598046 slm:000598046 WCJYZUFKKTYNLB-ARITWGJRSA-L
| (2Z,4E,7E)-2-hydroxy-6-oxonona-2,4,7-trienedioate
|
CHEBI:66939 chebi:66939 WCJYZUFKKTYNLB-ARITWGJRSA-N
| (2Z,4E,7E)-2-hydroxy-6-oxonona-2,4,7-trienedioic acid
|