144223-70-1 , Dehydroadynerigenin glucosyldigitaloside

144223-70-1 , Dehydroadynerigenin glucosyldigitaloside
Cas:144223-70-1
C36H52O13 / 692.79
MFCD28988631

Dehydroadynerigenin glucosyldigitaloside

Dehydroadynerigenin glucosyldigitaloside is a natural product that belongs to the class of flavonoids. It is a secondary metabolite found in plants and has many bioactive properties, such as antioxidant activity and anti-inflammatory effects.

CAS Number	144223-70-1
Product Name	3-[(1S,3R,7R,10R,11S,14S)-14-[(2R,3R,4S,5S,6R)-3-hydroxy-4-methoxy-6-methyl-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-7,11-dimethyl-2-oxapentacyclo[8.8.0.01,3.03,7.011,16]octadec-5-en-6-yl]-2H-furan-5-one
IUPAC Name	3-[(1S,3R,7R,10R,11S,14S)-14-[(2R,3R,4S,5S,6R)-3-hydroxy-4-methoxy-6-methyl-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-7,11-dimethyl-2-oxapentacyclo[8.8.0.01,3.03,7.011,16]octadec-5-en-6-yl]-2H-furan-5-one
Molecular Formula	C36H52O13
Molecular Weight	692.79
InChI	InChI=1S/C36H52O13/c1-17-29(48-31-27(41)26(40)25(39)22(15-37)47-31)30(43-4)28(42)32(45-17)46-20-6-9-33(2)19(14-20)5-11-35-23(33)8-10-34(3)21(7-12-36(34,35)49-35)18-13-24(38)44-16-18/h7,13,17,19-20,22-23,25-32,37,39-42H,5-6,8-12,14-16H2,1-4H3/t17-,19?,20+,22-,23-,25-,26+,27-,28-,29+,30+,31+,32+,33+,34-,35+,36-/m1/s1
InChI Key	ULJZNLQMTRZTJF-WPBYJKQESA-N
SMILES	CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC45C3CCC6(C4(O5)CC=C6C7=CC(=O)OC7)C)C)O)OC)OC8C(C(C(C(O8)CO)O)O)O
Synonyms	Dehydroadynerigenin glucosyldigitaloside