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ScientificNameLabel
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More Details :
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| Names & Synonyms: |
(2S,3R,4S,5S,6R)-2-[(1S)-1,5-dimethyl-1-vinyl-hex-4-enoxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol , (2S,3R,4S,5S,6R)-2-[(3S)-3,7-dimethylocta-1,6-dien-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol , (2S,3R,4S,5S,6R)-2-[(1S)-1,5-dimethyl-1-vinyl-hex-4-enoxy]-6-methylol-tetrahydropyran-3,4,5-triol
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| Smiles: |
OC[C@H]1O[C@@H](O[C@@](CCC=C(C)C)(C=C)C)[C@@H]([C@H]([C@@H]1O)O)O
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| InChi : |
InChI=1S/C16H28O6/c1-5-16(4,8-6-7-10(2)3)22-15-14(20)13(19)12(18)11(9-17)21-15/h5,7,11-15,17-20H,1,6,8-9H2,2-4H3/t11-,12-,13+,14-,15+,16-/m1/s1
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| InChi Key : |
InChIKey=FLXYFXDZJHWWGW-VJQRDGCPSA-N
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| PubChem ID : |
10087123
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| Rotatable bond count : |
7
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Rule of five : |
0
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| Hydrogen bond acceptor count : |
6
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Ionization potential : |
9.102192
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| Hydrogen bond donor count : |
4
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Electric dipole moment : |
1.665
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| XLogP : |
1.36
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VDW volume : |
320.404197
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| Molecular weight : |
316.188589
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HOMO-LUMO gap : |
9.988000
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| Herb list : |
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| Refrences & Litretures: |
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