HIT ID: HIT214316127
Cas No: 118101-72-7
分子式: C15H22O2
分子量: 234.339
常用名: Prehelminthosporolactone
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (1R,3R,7S,8S,9R)-1-methyl-2-methylidene-9-(propan-2-yl)-5-oxatricyclo[5.4.0.0^{3,8}]undecan-4-one
IUPAC: (1R,3R,7S,8S,9R)-1-methyl-2-methylidene-9-(propan-2-yl)-5-oxatricyclo[5.4.0.0^{3,8}]undecan-4-one
SMILES: [H][C@@]12COC(=O)[C@@]3([H])C(=C)[C@]1(C)CC[C@H](C(C)C)[C@@]23[H] |@@:15,TLB:14:18:10.8:4.3.2,11:10:18:4.3.2,THB:15:14:1:8.6,4:6:1:14.12.13,2:1:8.6:14.12.13,12:10:18:4.3.2|
SMILES: [H][C@@]12COC(=O)[C@@]3([H])C(=C)[C@]1(C)CC[C@H](C(C)C)[C@@]23[H] |@@:15,TLB:14:18:10.8:4.3.2,11:10:18:4.3.2,THB:15:14:1:8.6,4:6:1:14.12.13,2:1:8.6:14.12.13,12:10:18:4.3.2|
InChI key: YRJUYCPYOZTNDX-RDUIOHGSSA-N
