Name: Aldecalmycin
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT214318018
Cas No:139953-58-5
常用名:Aldecalmycin
IUPAC:3-[2-(4-hydroxy-3,5-dimethyl-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oct-5-en-1-yl)-1,3,6,8-tetramethyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]-3-oxopropanal
IUPAC:3-[2-(4-hydroxy-3,5-dimethyl-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oct-5-en-1-yl)-1,3,6,8-tetramethyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]-3-oxopropanal
InChI key:BKXWBAOGONGQJL-UHFFFAOYSA-N

分子式:C33H54O9
分子量:594.786
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CCC=C(C)C(O)C(C)C(CC1C(C)=CC2CC(C)CC(C)C2C1(C)C(=O)CC=O)OC1OC(CO)C(O)C(O)C1O |w:2.1,c:13|
SMILES:CCC=C(C)C(O)C(C)C(CC1C(C)=CC2CC(C)CC(C)C2C1(C)C(=O)CC=O)OC1OC(CO)C(O)C(O)C1O |w:2.1,c:13|

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