Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:31:05 UTC |
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Update Date | 2025-03-21 18:41:52 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00136522 |
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Frequency | 18.4 |
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Structure | |
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Chemical Formula | C34H40N4O8 |
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Molecular Mass | 632.2846 |
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SMILES | Cc1c2[nH]c(c1CCC(=O)O)Cc1[nH]c(c(CCC(=O)O)c1C)Cc1[nH]c(c(C(=O)O)c1C)Cc1[nH]c(c(C)c1CCC(=O)O)C2 |
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InChI Key | VWFXIEVJZVRQAO-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 | metalloporphyrins |
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Geometric Descriptor | aromatic heteropolycyclic compounds |
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Alternative Parents | 1-carboxy-2-haloaromatic compoundsazacyclic compoundscarbonyl compoundsheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsporphyrinspyrrole carboxylic acidstetracarboxylic acids and derivativesvinylogous amides |
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Substituents | carbonyl groupcarboxylic acidpyrrole-3-carboxylic acid or derivativescarboxylic acid derivativeorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound1-carboxy-2-haloaromatic compoundvinylogous amideporphyrinazacycleheteroaromatic compoundtetracarboxylic acid or derivativesorganic oxygen compoundpyrrolehydrocarbon derivativeorganic nitrogen compoundpyrrole-3-carboxylic acidorganooxygen compoundmetalloporphyrin |
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