Karaviloside VIII | CAS 934739-32-9

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HIT ID:HIT214311971
Cas No:934739-32-9
常用名:Karaviloside VIII
IUPAC:(2R,3R,4R,5S,6R)-2-{[(6S)-5-hydroxy-6-[(1R,4S,5S,8R,9R,12S,13S,16S)-16-hydroxy-5,9,17,17-tetramethyl-18-oxapentacyclo[10.5.2.0^{1,13}.0^{4,12}.0^{5,9}]nonadec-2-en-8-yl]-2-methylhept-2-en-4-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
IUPAC:(2R,3R,4R,5S,6R)-2-{[(6S)-5-hydroxy-6-[(1R,4S,5S,8R,9R,12S,13S,16S)-16-hydroxy-5,9,17,17-tetramethyl-18-oxapentacyclo[10.5.2.0^{1,13}.0^{4,12}.0^{5,9}]nonadec-2-en-8-yl]-2-methylhept-2-en-4-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
InChI key:KQDRBMHUHNJNGK-AYYDJOCWSA-N

分子式:C36H58O9
分子量:634.851
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[#6]-[#6@H](-[#6](-[#8])-[#6](-[#8]-[#6@@H]-1-[#8]-[#6@H](-[#6]-[#8])-[#6@@H](-[#8])-[#6@@H](-[#8])-[#6@H]-1-[#8])\[#6]=[#6](\[#6])-[#6])-[#6@H]1-[#6]-[#6][C@@]2([#6])[#6@@H]3-[#6]=[#6][C@@]45[#8]-[#6][C@]3([#6]-[#6][C@]12[#6])[#6@@H]4-[#6]-[#6]-[#6@H](-[#8])C5([#6])[#6] |c:28|
SMILES:[#6]-[#6@H](-[#6](-[#8])-[#6](-[#8]-[#6@@H]-1-[#8]-[#6@H](-[#6]-[#8])-[#6@@H](-[#8])-[#6@@H](-[#8])-[#6@H]-1-[#8])\[#6]=[#6](\[#6])-[#6])-[#6@H]1-[#6]-[#6][C@@]2([#6])[#6@@H]3-[#6]=[#6][C@@]45[#8]-[#6][C@]3([#6]-[#6][C@]12[#6])[#6@@H]4-[#6]-[#6]-[#6@H](-[#8])C5([#6])[#6] |c:28|

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