| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 11:41:51 UTC |
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| Update Date | 2025-03-24 21:17:57 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01734691 |
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| Frequency | 0.7 |
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| Structure | |
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| Chemical Formula | C46H43N5O18 |
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| Molecular Mass | 953.2603 |
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| SMILES | O=C(O)CCC1=C(CC(=O)O)c2cc3c(CC(=O)O)c(cc4[nH]c(cc5nc(cc6[nH]c(cc1n2)c(CCC(=O)O)c6CC(=O)O)C(CCC(=O)O)=C5CC(=O)O)c(CCC(=O)O)c4CC(=O)O)N3 |
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| InChI Key | WDEFVJRJLTTZQO-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 | amino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganopnictogen compoundspyrrolessecondary amines |
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| Substituents | carbonyl groupcarboxylic acidazacycleamino acid or derivativesamino acidheteroaromatic compoundsecondary aminecarboxylic acid derivativeorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundpyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundmetallotetrapyrrole skeletonorganooxygen compoundamine |
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