Search MNXref
SystemsX.ch
The Swiss Initiative in Systems Biology
 Feedback

Apigenin 7-(6''-malonylneohesperidoside)

PropertiesImageOccurences in reactions
MNX_IDMNXM42355Image of MNXM42355
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC30H32O17
charge0
mass664.16395
referencechebi:169094
InChIKeyFZDRRQITRWLLCV-FDUHKKDTSA-N
InChIInChI=1S/C30H32O17/c1-11-23(37)25(39)27(41)29(43-11)47-28-26(40)24(38)19(10-42-21(36)9-20(34)35)46-30(28)44-14-6-15(32)22-16(33)8-17(45-18(22)7-14)12-2-4-13(31)5-3-12/h2-8,11,19,23-32,37-41H,9-10H2,1H3,(H,34,35)/t11?,19?,23-,24+,25-,26-,27?,28?,29-,30+/m0/s1
SMILESCC1O[C@@H](OC2[C@H](Oc3cc(O)c4c(=O)cc(-c5ccc(O)cc5)oc4c3)OC(COC(=O)CC(=O)O)[C@@H](O)[C@@H]2O)C(O)[C@@H](O)[C@H]1O
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:169094
chebi:169094 		Apigenin 7-(6''-malonylneohesperidoside)
3-[[(3S,4S,6S)-3,4-dihydroxy-6-[5-hydroxy-2-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxy-5-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]methoxy]-3-oxopropanoic acid
lipidmaps:LMPK12110386
lipidmapsM:LMPK12110386 		Apigenin 7-(6''-malonylneohesperidoside)