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mallotophilippen B

PropertiesImage
MNX_IDMNXM106407 Image of MNXM106407
referencechebi:66656
formulaC26H30O8
global charge0
mol weight470.518
InChIKeyQDQSOVCXTNDOAI-UHFFFAOYSA-N
InChIInChI=1S/C26H30O8/c1-7-11(2)19(28)18-24(33)16(22(31)14-8-9-26(5,6)34-25(14)18)10-15-20(29)12(3)21(30)17(13(4)27)23(15)32/h8-9,11,29-33H,7,10H2,1-6H3
SMILESCCC(C)C(=O)C1=C2OC(C)(C)C=CC2=C(O)C(CC2=C(O)C(C(C)=O)=C(O)C(C)=C2O)=C1O
MNX internals
InChI (mnx)InChI=1/C26H30O8/c1-7-11(2)19(28)18-24(33)16(22(31)14-8-9-26(5,6)34-25(14)18)10-15-20(29)12(3)21(30)17(13(4)27)23(15)32/h8-9,11,29-33H,7,10H2,1-6H3/t11? Image of MNXM106407
SMILES (mnx)[CH3:1][CH2:7][CH:11]([CH3:2])[C:19]([C:18]1=[C:25]2[C:14](=[C:22]([OH:31])[C:16]([CH2:10][C:15]3=[C:23]([OH:32])[C:17]([C:13]([CH3:4])=[O:27])=[C:21]([OH:30])[C:12]([CH3:3])=[C:20]3[OH:29])=[C:24]1[OH:33])[CH:8]=[CH:9][C:26]([CH3:5])([CH3:6])[O:34]2)=[O:28]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:66656
chebi:66656
QDQSOVCXTNDOAI-UHFFFAOYSA-N
mallotophilippen B
1-[6-(3-acetyl-2,4,6-trihydroxy-5-methylbenzyl)-5,7-dihydroxy-2,2-dimethyl-2H-chromen-8-yl]-2-methylbutan-1-one