Name: 7,8,7’,8’-Tetradehydroastaxanthin
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT220772654
Cas No:63357-63-1
常用名:7,8,7’,8’-Tetradehydroastaxanthin
常用名:7,8,7’,8’-Tetradehydroastaxanthin
IUPAC:6-hydroxy-3-[(3E,5E,7E,9E,11E,13E,15E)-18-(4-hydroxy-2,6,6-trimethyl-3-oxocyclohex-1-en-1-yl)-3,7,12,16-tetramethyloctadeca-3,5,7,9,11,13,15-heptaen-1,17-diyn-1-yl]-2,4,4-trimethylcyclohex-2-en-1-one
IUPAC:6-hydroxy-3-[(3E,5E,7E,9E,11E,13E,15E)-18-(4-hydroxy-2,6,6-trimethyl-3-oxocyclohex-1-en-1-yl)-3,7,12,16-tetramethyloctadeca-3,5,7,9,11,13,15-heptaen-1,17-diyn-1-yl]-2,4,4-trimethylcyclohex-2-en-1-one
InChI key:InChIKey=NNUVZGQKBVLNIO-BXOKDNRRSA-N

分子式:C40H48O4
分子量:592.82
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:C\C(\C=C\C=C(/C)C#CC1=C(C)C(=O)C(O)CC1(C)C)=C/C=C/C=C(\C)/C=C/C=C(\C)C#CC1=C(C)C(=O)C(O)CC1(C)C
SMILES:C\C(\C=C\C=C(/C)C#CC1=C(C)C(=O)C(O)CC1(C)C)=C/C=C/C=C(\C)/C=C/C=C(\C)C#CC1=C(C)C(=O)C(O)CC1(C)C

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