Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:37:15 UTC |
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Update Date | 2025-03-25 00:45:28 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02149344 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C27H44O3 |
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Molecular Mass | 416.329 |
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SMILES | CC(=O)CCCC(C)C1CCC2C3=C(CC(O)C21)C1(C)CCC(O)C(C)(C)C1CC3 |
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InChI Key | BMHXAZODYYXXHY-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 | oxosteroids |
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Direct Parent | oxosteroids |
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Geometric Descriptor | aliphatic homopolycyclic compounds |
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Alternative Parents | 12-hydroxysteroids3-hydroxysteroidscyclic alcohols and derivativesditerpenoidshydrocarbon derivativesketonesorganic oxidessecondary alcohols |
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Substituents | alcoholcarbonyl group12-hydroxysteroid25-oxosteroidoxosteroidabietane diterpenoid3-hydroxysteroidhydroxysteroidcyclic alcoholaliphatic homopolycyclic compoundketoneorganic oxideorganic oxygen compoundsecondary alcoholhydrocarbon derivativediterpenoidorganooxygen compound |
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