Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:40:52 UTC |
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Update Date | 2025-03-25 00:46:51 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02157720 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C40H38N4O17 |
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Molecular Mass | 846.2232 |
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SMILES | O=C(O)CCC1=C(CC(=O)O)c2cc3[nH]c(cc4nc(cc5[nH]c(cc1n2)c(CC(=O)O)c5CCC(=O)O)C(CCC(=O)O)=C4CC(=O)O)c(C(O)C(=O)O)c3CCC(=O)O |
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InChI Key | YJOURZCTCDZNQD-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 | alpha hydroxy acids and derivativesaromatic alcoholsazacyclic compoundscarbonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolessecondary alcohols |
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Substituents | aromatic alcoholalcoholcarbonyl groupcarboxylic acidazacyclealpha-hydroxy acidheteroaromatic compoundhydroxy acidcarboxylic acid derivativeorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundpyrroleorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundmetallotetrapyrrole skeletonorganooxygen compound |
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