Name: (1'S,2S,2'R,7'R,9'R,10'R,11'S)-11'-(acetyloxy)-10'-hydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0^{2,7}]dodecan]-5'-en-2'-ylmethyl acetate
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类似物检索

HIT ID:HIT212708514
Cas No:2270-40-8
常用名:(1'S,2S,2'R,7'R,9'R,10'R,11'S)-11'-(acetyloxy)-10'-hydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0^{2,7}]dodecan]-5'-en-2'-ylmethyl acetate
常用名:(1'S,2S,2'R,7'R,9'R,10'R,11'S)-11'-(acetyloxy)-10'-hydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0^{2,7}]dodecan]-5'-en-2'-ylmethyl acetate
IUPAC:[(1'S,2S,2'R,7'R,9'R,10'R,11'S)-11'-(acetyloxy)-10'-hydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0^{2,7}]dodecan]-5'-en-2'-yl]methyl acetate
IUPAC:[(1'S,2S,2'R,7'R,9'R,10'R,11'S)-11'-(acetyloxy)-10'-hydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0^{2,7}]dodecan]-5'-en-2'-yl]methyl acetate
InChI key:AUGQEEXBDZWUJY-NMAPUUFXSA-N

分子式:C19H26O7
分子量:366.41
氢键供体数 (HBD):1
氢键受体数 (HBA):5
LogP:0.37699962
SMILES:[H][C@]12O[C@@H]3[C@H](O)[C@@H](OC(C)=O)[C@@](C)([C@]33CO3)[C@@]1(COC(C)=O)CCC(C)=C2 |c:28,TLB:26:1:6.4:13,22:16:6.4:13,THB:17:16:6.4:13|
SMILES:[H][C@]12O[C@@H]3[C@H](O)[C@@H](OC(C)=O)[C@@](C)([C@]33CO3)[C@@]1(COC(C)=O)CCC(C)=C2 |c:28,TLB:26:1:6.4:13,22:16:6.4:13,THB:17:16:6.4:13|

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