[(1S,2R,4S,4aR,5R,6S,8aR)-4-acetoxy-6-hydroxy-1,2-dimethyl-1-[2-(5-oxo-2H-furan-3-yl)ethyl]spiro[decalin-5,2'-oxirane]-4a-yl]methyl (E)-2-methylbut-2-enoate (BioDeep_00002112972)

代谢物信息卡片

[(3S,4R,4aR,5S,7R,8S,8aR)-5-acetyloxy-3-hydroxy-7,8-dimethyl-8-[2-(5-oxo-2H-furan-3-yl)ethyl]spiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-4a-yl]methyl (E)-2-methylbut-2-enoate; (E)-2-methylbut-2-enoic acid [(1S,2R,4S,4aR,5R,6S,8aR)-4-acetoxy-6-hydroxy-1,2-dimethyl-1-[2-(5-oxo-2H-furan-3-yl)ethyl]-4a-spiro[decalin-5,2'-oxirane]yl]methyl ester; (E)-2-methylbut-2-enoic acid [(1S,2R,4S,4aR,5R,6S,8aR)-4-acetoxy-6-hydroxy-1-[2-(5-keto-2H-furan-3-yl)ethyl]-1,2-dimethyl-spiro[decalin-5,2'-oxirane]-4a-yl]methyl ester

化学式: C27H38O8 (490.2566548)
中文名称:
谱图信息: 最多检出来源 () 0%

分子结构信息

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InChI:

描述信息

{"Ingredient_id": "HBIN003211","Ingredient_name": "[(1S,2R,4S,4aR,5R,6S,8aR)-4-acetoxy-6-hydroxy-1,2-dimethyl-1-[2-(5-oxo-2H-furan-3-yl)ethyl]spiro[decalin-5,2'-oxirane]-4a-yl]methyl (E)-2-methylbut-2-enoate","Alias": "[(3S,4R,4aR,5S,7R,8S,8aR)-5-acetyloxy-3-hydroxy-7,8-dimethyl-8-[2-(5-oxo-2H-furan-3-yl)ethyl]spiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-4a-yl]methyl (E)-2-methylbut-2-enoate; (E)-2-methylbut-2-enoic acid [(1S,2R,4S,4aR,5R,6S,8aR)-4-acetoxy-6-hydroxy-1,2-dimethyl-1-[2-(5-oxo-2H-furan-3-yl)ethyl]-4a-spiro[decalin-5,2'-oxirane]yl]methyl ester; (E)-2-methylbut-2-enoic acid [(1S,2R,4S,4aR,5R,6S,8aR)-4-acetoxy-6-hydroxy-1-[2-(5-keto-2H-furan-3-yl)ethyl]-1,2-dimethyl-spiro[decalin-5,2'-oxirane]-4a-yl]methyl ester","Ingredient_formula": "C27H38O8","Ingredient_Smile": "NA","Ingredient_weight": "490.59","OB_score": "31.33213579","CAS_id": "124961-69-9","SymMap_id": "SMIT09136","TCMID_id": "NA","TCMSP_id": "MOL007759","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

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