Apigenin-6-C-rhamnoside-8-C-arabinoside

ScientificNameLabel

Apigenin-6-C-rhamnoside-8-C-arabinoside
PHCD compound ID :	4308
Chemical Names :	Apigenin-6-C-rhamnoside-8-C-arabinoside
Molecular Formula :	C26H28O13
Molecular Weight :	548.152991

More Details :

Names & Synonyms:
Smiles:	Oc1ccc(cc1)c1cc(=O)c2c(o1)c([C@@H]1OC[C@@H]([C@@H]([C@H]1O)O)O)c(c(c2O)[C@@H]1O[C@H](C)[C@H]([C@@H]([C@H]1O)O)O)O
InChi :	InChI=1S/C26H28O13/c1-8-17(30)21(34)23(36)26(38-8)15-19(32)14-11(28)6-13(9-2-4-10(27)5-3-9)39-24(14)16(20(15)33)25-22(35)18(31)12(29)7-37-25/h2-6,8,12,17-18,21-23,25-27,29-36H,7H2,1H3/t8-,12+,17-,18+,21+,22-,23-,25+,26+/m1/s1
InChi Key :	InChIKey=MYFLUHAHDISFPN-QPUDPDQRSA-N
PubChem ID :

Rotatable bond count :	3	Rule of five :	2
Hydrogen bond acceptor count :	13	Ionization potential :	9.410407
Hydrogen bond donor count :	9	Electric dipole moment :	3.261
XLogP :	-1.606	VDW volume :	467.851043
Molecular weight :	548.152991	HOMO-LUMO gap :	8.586000

Herb list :

Passion flower, Blue passionflower - Passiflora caerulea - گل ساعتی

Refrences & Litretures:


629. Journal:'Anal Bioanal Chem' Year:'2016' Volume:'408' Page:'3125' DOI:'10.1007/s00216-016-9376-4' Title:'Comparative metabolite profiling and fingerprinting of genus Passiflora leaves using a multiplex approach of UPLC-MS and NMR analyzed by chemometric tools'

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