| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:11:14 UTC |
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| Update Date | 2025-03-25 00:57:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02227120 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C28H46O4 |
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| Molecular Mass | 446.3396 |
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| SMILES | CC(CCCCC(=O)O)C1CCC2C3=C(CCC21C)C1(C)CCC(O)C(C)(C)C1CC3O |
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| InChI Key | NPJLUSTUPUBWIK-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 | androstane steroids |
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| Direct Parent | androgens and derivatives |
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| Geometric Descriptor | aliphatic homopolycyclic compounds |
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| Alternative Parents | 3-hydroxysteroids7-hydroxysteroidscarbocyclic fatty acidscarbonyl compoundscarboxylic acidscyclic alcohols and derivativesditerpenoidsfatty acylshydrocarbon derivativeshydroxy fatty acidsmedium-chain fatty acidsmedium-chain hydroxy acids and derivativesmonocarboxylic acids and derivativesorganic oxidessecondary alcohols |
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| Substituents | fatty acylcarbocyclic fatty acidcarbonyl groupcarboxylic acidandrogen-skeletonabietane diterpenoidcarboxylic acid derivativemedium-chain hydroxy acidaliphatic homopolycyclic compoundorganic oxidemedium-chain fatty acidhydroxy fatty acidalcohol3-hydroxysteroidhydroxysteroidcyclic alcohol7-hydroxysteroidmonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativediterpenoidorganooxygen compound |
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