Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:55:32 UTC |
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Update Date | 2025-03-25 00:52:02 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02191075 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C49H48N6O9 |
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Molecular Mass | 864.3483 |
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SMILES | C=CC1=C(C)C(=CC2=NC(=Cc3[nH]c(C=C4N=C(C=C5NC(=O)C(C=C)=C5C)C(C)=C4CCC(=O)O)c(CCC(=O)O)c3C=C3NC(=O)C(C=C)=C3C)C(CCC(=O)O)=C2C)NC1=O |
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InChI Key | RRMNXHDGMAHPEE-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 heteromonocyclic compounds |
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Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidsdipyrrinsheteroaromatic compoundshydrocarbon derivativesketimineslactamsorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundspyrrolespyrrolinessecondary carboxylic acid amidestricarboxylic acids and derivatives |
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Substituents | ketiminecarbonyl grouplactamcarboxylic acidaromatic heteromonocyclic compoundiminetricarboxylic acid or derivativescarboxylic acid derivativepropargyl-type 1,3-dipolar organic compounddipyrrinorganic oxideorganonitrogen compoundorganopnictogen compoundmetallotetrapyrrole skeletonazacycleheteroaromatic compoundorganic 1,3-dipolar compoundcarboxamide groupsecondary carboxylic acid amideorganic oxygen compoundpyrrolinepyrrolehydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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