HIT ID: HIT213886782
Cas No: 39763-33-2
分子式: C13H18O3
分子量: 222.284
常用名: Dehydrovomifoliol
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (4S)-4-hydroxy-3,5,5-trimethyl-4-[(1E)-3-oxobut-1-en-1-yl]cyclohex-2-en-1-one
IUPAC: (4S)-4-hydroxy-3,5,5-trimethyl-4-[(1E)-3-oxobut-1-en-1-yl]cyclohex-2-en-1-one
SMILES: CC(=O)\C=C\[C@@]1(O)C(C)=CC(=O)CC1(C)C |c:8|
SMILES: CC(=O)\C=C\[C@@]1(O)C(C)=CC(=O)CC1(C)C |c:8|
InChI key: JJRYPZMXNLLZFH-URWSZGRFSA-N
