Name: Extensumside F
Rating: 5 (10 reviews)

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HIT ID:HIT212524817
Cas No:2079912-12-0
常用名:Extensumside F
IUPAC:(2R,3R,4S,6S)-6-{[(2R,3R,4S,6S)-6-{[(2R,3R,4R,5R,6R)-6-{[(1R,2R,7S,9aR,11aS)-1-acetyl-9a,11a-dimethyl-2-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-yl]oxy}-5-hydroxy-4-methoxy-2-methyloxan-3-yl]oxy}-4-methoxy-2-methyloxan-3-yl]oxy}-4-methoxy-2-methyloxan-3-yl 3-methylbut-2-enoate
IUPAC:(2R,3R,4S,6S)-6-{[(2R,3R,4S,6S)-6-{[(2R,3R,4R,5R,6R)-6-{[(1R,2R,7S,9aR,11aS)-1-acetyl-9a,11a-dimethyl-2-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-yl]oxy}-5-hydroxy-4-methoxy-2-methyloxan-3-yl]oxy}-4-methoxy-2-methyloxan-3-yl]oxy}-4-methoxy-2-methyloxan-3-yl 3-methylbut-2-enoate
InChI key:AIQUYORIPKCSAN-VXOOOPLISA-N

分子式:C65H104O29
分子量:1349.518
氢键供体数 (HBD):11
氢键受体数 (HBA):28
LogP:0.658
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SMILES:[#6]-[#8]-[#6@H]-1-[#6]-[#6@H](-[#8]-[#6@@H]-2-[#6@@H](-[#6])-[#8]-[#6@@H](-[#8]-[#6@H]-3-[#6]-[#6][C@]4([#6])[#6]-5-[#6]-[#6][C@@]6([#6])[#6](-[#6]-[#6@@H](-[#8]-[#6@@H]-7-[#8]-[#6@H](-[#6]-[#8]-[#6@@H]-8-[#8]-[#6@H](-[#6]-[#8]-[#6@@H]-9-[#8]-[#6@H](-[#6]-[#8])-[#6@@H](-[#8])-[#6@H](-[#8])-[#6@H]-9-[#8])-[#6@@H](-[#8])-[#6@H](-[#8])-[#6@H]-8-[#8])-[#6@@H](-[#8])-[#6@H](-[#8])-[#6@H]-7-[#8])-[#6@@H]6-[#6](-[#6])=O)-[#6]-5-[#6]-[#6]=[#6]4-[#6]-3)-[#6@H](-[#8])-[#6@H]-2-[#8]-[#6])-[#8]-[#6@H](-[#6])-[#6@H]-1-[#8]-[#6@H]-1-[#6]-[#6@H](-[#8]-[#6])-[#6@H](-[#8]-[#6](=O)\[#6]=[#6](\[#6])-[#6])-[#6@@H](-[#6])-[#8]-1 |c:70|

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