HIT ID: HIT212730033
Cas No: 27415-25-4
分子式: C20H32O5
分子量: 352.471
常用名: 8-iso Prostaglandin E2
氢键受体数 (HBA): 5
氢键供体数 (HBD): 3
LogP: 3.22527
IUPAC: (5Z)-7-[(1S,2R,3R)-3-hydroxy-2-[(1E,3S)-3-hydroxyoct-1-en-1-yl]-5-oxocyclopentyl]hept-5-enoic acid
IUPAC: (5Z)-7-[(1S,2R,3R)-3-hydroxy-2-[(1E,3S)-3-hydroxyoct-1-en-1-yl]-5-oxocyclopentyl]hept-5-enoic acid
SMILES: CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@H]1C\C=C/CCCC(O)=O
SMILES: CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@H]1C\C=C/CCCC(O)=O
InChI key: XEYBRNLFEZDVAW-CLQOMRTCSA-N
