Name: Momordicine V
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT214316055
Cas No:1012315-36-4
常用名:Momordicine V
IUPAC:3-{[(1R,3aS,3bS,4S,7S,9aR,9bR,11aR)-9b-formyl-4-hydroxy-3a,6,6,11a-tetramethyl-1-[(2R)-6-methyl-4-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hept-5-en-2-yl]-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-yl]oxy}-3-oxopropanoic acid
IUPAC:3-{[(1R,3aS,3bS,4S,7S,9aR,9bR,11aR)-9b-formyl-4-hydroxy-3a,6,6,11a-tetramethyl-1-[(2R)-6-methyl-4-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hept-5-en-2-yl]-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-yl]oxy}-3-oxopropanoic acid
InChI key:LWNCCLUCDGANTA-BGGZWTQLSA-N

分子式:C39H60O12
分子量:720.897
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@@]1([#6]-[#6][C@@]2([#6])[C@]3([H])[#6@@H](-[#8])-[#6]=[#6]4[C@@]([H])([#6]-[#6]-[#6@H](-[#8]-[#6](=O)-[#6]-[#6](-[#8])=O)C4([#6])[#6])[C@@]3([#6]-[#6][C@]12[#6])[#6]=O)[#6@H](-[#6])-[#6]-[#6](-[#8]-[#6@@H]-1-[#8]-[#6@H](-[#6]-[#8])-[#6@@H](-[#8])-[#6@H](-[#8])-[#6@H]-1-[#8])\[#6]=[#6](\[#6])-[#6] |c:10|
SMILES:[H][C@@]1([#6]-[#6][C@@]2([#6])[C@]3([H])[#6@@H](-[#8])-[#6]=[#6]4[C@@]([H])([#6]-[#6]-[#6@H](-[#8]-[#6](=O)-[#6]-[#6](-[#8])=O)C4([#6])[#6])[C@@]3([#6]-[#6][C@]12[#6])[#6]=O)[#6@H](-[#6])-[#6]-[#6](-[#8]-[#6@@H]-1-[#8]-[#6@H](-[#6]-[#8])-[#6@@H](-[#8])-[#6@H](-[#8])-[#6@H]-1-[#8])\[#6]=[#6](\[#6])-[#6] |c:10|

Momordicine V can deter significantly the oviposition by L. trifolii on host plant leaves treated at 26.16 microg/cm2 leaf surface.

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