Name: 6alpha-Hydroxydehydropachymic acid
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT218679438
Cas No:
常用名:6alpha-Hydroxydehydropachymic acid
常用名:6alpha-Hydroxydehydropachymic acid
IUPAC:2-[7-(acetyloxy)-2,5-dihydroxy-3a,6,6,9a,11a-pentamethyl-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9aH,11H,11aH-cyclopenta[a]phenanthren-1-yl]-6-methyl-5-methylideneheptanoic acid
IUPAC:2-[7-(acetyloxy)-2,5-dihydroxy-3a,6,6,9a,11a-pentamethyl-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9aH,11H,11aH-cyclopenta[a]phenanthren-1-yl]-6-methyl-5-methylideneheptanoic acid
InChI key:GTBRWZWDDPYVGX-UHFFFAOYSA-N

分子式:C33H50O6
分子量:542.757
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CC(C)C(=C)CCC(C1C(O)CC2(C)C3=CC(O)C4C(C)(C)C(CCC4(C)C3=CCC12C)OC(C)=O)C(O)=O
SMILES:CC(C)C(=C)CCC(C1C(O)CC2(C)C3=CC(O)C4C(C)(C)C(CCC4(C)C3=CCC12C)OC(C)=O)C(O)=O

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