7-[2-(3-hydroxyocta-1,5-dien-1-yl)-5-oxocyclopent-1-en-1-yl]hept-5-enoic acid, Prostaglandin B3
HIT218832629
sdf文件结构编辑类似物检索
HIT ID: HIT218832629
Cas No:
分子式: C20H28O4
分子量: 332.44
常用名: 7-[2-(3-hydroxyocta-1,5-dien-1-yl)-5-oxocyclopent-1-en-1-yl]hept-5-enoic acid, Prostaglandin B3
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 7-[2-(3-hydroxyocta-1,5-dien-1-yl)-5-oxocyclopent-1-en-1-yl]hept-5-enoic acid
SMILES: CCC=CCC(O)C=CC1=C(CC=CCCCC(O)=O)C(=O)CC1
InChI key: DQRGQQAJYRBDRP-UHFFFAOYSA-N
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