| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:55:13 UTC |
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| Update Date | 2025-03-25 00:51:56 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02190380 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C29H46O3 |
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| Molecular Mass | 442.3447 |
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| SMILES | CC(=CCCC(C)C1CCC2C3=C(CCC21C)C1(C)CCC(O)C(C)(C)C1CC3)C(=O)O |
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| InChI Key | QCKANWDJDGKCNY-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | steroids and steroid derivatives |
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| Subclass | hydroxysteroids |
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| Direct Parent | hydroxysteroids |
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| Geometric Descriptor | aliphatic homopolycyclic compounds |
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| Alternative Parents | 3-hydroxysteroidsbile acids, alcohols and derivativescarbonyl compoundscarboxylic acidscyclic alcohols and derivativeshydrocarbon derivativeshydroxy fatty acidsmedium-chain fatty acidsmedium-chain hydroxy acids and derivativesmonocarboxylic acids and derivativesorganic oxidessecondary alcoholstriterpenoidsunsaturated fatty acids |
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| Substituents | fatty acylpolycyclic triterpenoidcarbonyl groupcarboxylic acidfatty acidcarboxylic acid derivativebile acid, alcohol, or derivativesmedium-chain hydroxy acidaliphatic homopolycyclic compoundtriterpenoidunsaturated fatty acidorganic oxidemedium-chain fatty acidhydroxy fatty acidalcohol3-hydroxysteroidhydroxysteroidcyclic alcoholmonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganooxygen compound |
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