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Apigenin 6-arabinose 8-glactose
ScientificNameLabel
Apigenin 6-arabinose 8-glactose
PHCD compound ID :
5307
Chemical Names :
Apigenin 6-arabinose 8-glactose
Molecular Formula :
C26H28O14
Molecular Weight :
564.147906
More Details :
Names & Synonyms:
Smiles:
OC[C@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O)c1c(O)c([C@@H]2OC[C@@H]([C@@H]([C@H]2O)O)O)c(c2c1oc(cc2=O)c1ccc(cc1)O)O
InChi :
InChI=1S/C26H28O14/c27-6-13-18(32)21(35)23(37)26(40-13)16-20(34)15(25-22(36)17(31)11(30)7-38-25)19(33)14-10(29)5-12(39-24(14)16)8-1-3-9(28)4-2-8/h1-5,11,13,17-18,21-23,25-28,30-37H,6-7H2/t11-,13+,17-,18+,21-,22+,23+,25-,26-/m0/s1
InChi Key :
InChIKey=OVMFOVNOXASTPA-VYUBKLCTSA-N
PubChem ID :
Rotatable bond count :
4
Rule of five :
2
Hydrogen bond acceptor count :
14
Ionization potential :
9.351591
Hydrogen bond donor count :
10
Electric dipole moment :
4.389
XLogP :
-2.309
VDW volume :
476.64127
Molecular weight :
564.147906
HOMO-LUMO gap :
8.263000
Herb list :
Anis estrellado, Star anise - Illicium verum - انیسون ستارهای، بادیان خَتایی
Refrences & Litretures:
858. Journal:'Indo Am. J. P. Sci' Year:'2019' Volume:'6' Page:'4138' DOI:'' Title:'CHEMICAL COMPOSITION OF ILLICIUM VERUM (STAR ANISE) FRUIT'
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