| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:06:07 UTC |
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| Update Date | 2025-03-25 00:56:00 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02215482 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C33H52O11 |
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| Molecular Mass | 624.351 |
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| SMILES | CC1CCC2C(CC(O)C3C2CCC2CC(OC4OC(C(=O)O)C(O)C(O)C4O)CCC23C)C1CCC1CC(O)CC(=O)O1 |
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| InChI Key | ZRUHSEKMBDFDJU-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 heteropolycyclic compounds |
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| Alternative Parents | 6-hydroxysteroidsacetalsbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acid esterscarboxylic acidscyclic alcohols and derivativesdelta valerolactonesdicarboxylic acids and derivativesditerpene glycosidesditerpene lactonesditerpenoidsglucuronic acid derivativeshydrocarbon derivativesmonosaccharideso-glucuronidesorganic oxidesoxacyclic compoundsoxanespyran carboxylic acidssecondary alcoholssteroid lactones |
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| Substituents | carbonyl groupcarboxylic acidglucuronic acid or derivativesabietane diterpenoiddelta valerolactoneo-glucuronidemonosaccharidecarboxylic acid derivativesteroid lactonepyran carboxylic acidditerpene glycosidelactone1-o-glucuronidealiphatic heteropolycyclic compoundbeta-hydroxy acidsaccharideorganic oxideacetaloxanedelta_valerolactoneorganoheterocyclic compoundalcoholpyran carboxylic acid or derivativesditerpene lactonehydroxysteroidterpene glycosidehydroxy acidcyclic alcoholoxacycleorganic oxygen compoundpyrancarboxylic acid estersecondary alcoholdicarboxylic acid or derivativeshydrocarbon derivative6-hydroxysteroidditerpenoidorganooxygen compound |
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