Feedback

(S)-Multifidol 2-[apiosyl-(1->6)-glucoside]

Properties

Image

Occurences in reactions

MNX_ID

MNXM115461

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₂₂H₃₂O₁₃

charge

mass

504.18429

reference

chebi:173280

InChIKey

MXXCYHQPSVRPOP-UHFFFAOYSA-N

InChI

InChI=1S/C22H32O13/c1-3-9(2)15(26)14-11(25)4-10(24)5-12(14)34-20-18(29)17(28)16(27)13(35-20)6-32-21-19(30)22(31,7-23)8-33-21/h4-5,9,13,16-21,23-25,27-31H,3,6-8H2,1-2H3

SMILES

CCC(C)C(=O)c1c(O)cc(O)cc1OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:173280 chebi:173280	(S)-Multifidol 2-[apiosyl-(1->6)-glucoside] 1-[2-[6-[[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4,6-dihydroxyphenyl]-2-methylbutan-1-one
hmdb:HMDB0039930	(S)-Multifidol 2-[apiosyl-(1->6)-glucoside] 1-(2-{[6-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-4,6-dihydroxyphenyl)-2-methylbutan-1-one
hmdb:HMDB39930	secondary/obsolete/fantasy identifier