| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 16:57:34 UTC |
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| Update Date | 2025-03-25 01:38:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02473352 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C42H40N4O17 |
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| Molecular Mass | 872.2388 |
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| SMILES | O=C(O)CCC(=O)c1c(CCC(=O)O)c2cc3nc(cc4[nH]c(cc5nc(cc1[nH]2)C(CCC(=O)O)=C5CC(=O)O)c(CCC(=O)O)c4CC(=O)O)C(CC(=O)O)=C3CCC(=O)O |
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| InChI Key | NEGVQINBYGWVAF-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | tetrapyrroles and derivatives |
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| Subclass | metallotetrapyrroles |
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| Direct Parent | metallotetrapyrroles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | aryl alkyl ketonesazacyclic compoundscarboxylic acidsgamma-keto acids and derivativesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolesvinylogous amides |
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| Substituents | vinylogous amidecarbonyl groupcarboxylic acidaryl alkyl ketoneazacycleheteroaromatic compoundcarboxylic acid derivativegamma-keto acidketoneorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundketo acidpyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundmetallotetrapyrrole skeletonorganooxygen compoundaryl ketone |
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