HIT ID: HIT214321315
Cas No: 145375-81-1
分子式: C21H30O4
分子量: 346.467
常用名: 13,14-dehydro-15-cyclohexyl Carbaprostacyclin
常用名: 13,14-dehydro-15-cyclohexyl Carbaprostacyclin
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 5-[(2E,3aS,4S,5R,6aS)-5-hydroxy-4-[2-(1-hydroxycyclohexyl)ethynyl]-octahydropentalen-2-ylidene]pentanoic acid
IUPAC: 5-[(2E,3aS,4S,5R,6aS)-5-hydroxy-4-[2-(1-hydroxycyclohexyl)ethynyl]-octahydropentalen-2-ylidene]pentanoic acid
SMILES: [H][C@]12C[C@@H](O)[C@H](C#CC3(O)CCCCC3)[C@@]1([H])C\C(C2)=C\CCCC(O)=O
SMILES: [H][C@]12C[C@@H](O)[C@H](C#CC3(O)CCCCC3)[C@@]1([H])C\C(C2)=C\CCCC(O)=O
InChI key: LGIPMFCHTFFLFR-PRYZLTTQSA-N
