Name: Carnaubadiol
Rating: 5 (10 reviews)

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HIT ID:HIT212038783
Cas No:4547-30-2
常用名:Carnaubadiol
IUPAC:(1S,3aR,3bR,5aR,7S,9aR,9bR,11aR)-1-[(2S,5R)-2-hydroxy-5,6-dimethylhept-6-en-2-yl]-3a,3b,6,6,9a-pentamethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-7-ol
IUPAC:(1S,3aR,3bR,5aR,7S,9aR,9bR,11aR)-1-[(2S,5R)-2-hydroxy-5,6-dimethylhept-6-en-2-yl]-3a,3b,6,6,9a-pentamethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-7-ol
InChI key:BPDZJMCTHRVRNC-UNXKSWITSA-N

分子式:C31H54O2
分子量:458.771
氢键供体数 (HBD):2
氢键受体数 (HBA):2
LogP:7.1856556
SMILES:[H][C@@]1(CC[C@]2(C)[C@]1([H])CC[C@]1([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@@]21C)[C@@](C)(O)CC[C@@H](C)C(C)=C
SMILES:[H][C@@]1(CC[C@]2(C)[C@]1([H])CC[C@]1([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@@]21C)[C@@](C)(O)CC[C@@H](C)C(C)=C

Carnaubadiol is a triterpene that has been found in E. corollata and has antiprotozoal activities.1,2 It is active against L. infantum promastigotes and amastigotes, as well as T. cruzi trypomastigotes (IC50s = 46.2, 7.8, and 14.9 μM, respectively).2

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