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(1S,4R)-10-Hydroxyfenchone glucoside

PropertiesImage
MNX_IDMNXM114928 Image of MNXM114928
referencechebi:168123
formulaC16H26O7
global charge0
mol weight330.377
InChIKeyWERYFGDRRGZFRG-UHFFFAOYSA-N
InChIInChI=1S/C16H26O7/c1-15(2)8-3-4-16(5-8,14(15)21)7-22-13-12(20)11(19)10(18)9(6-17)23-13/h8-13,17-20H,3-7H2,1-2H3
SMILESCC1(C)C(=O)C2(COC3OC(CO)C(O)C(O)C3O)CCC1C2
MNX internals
InChI (mnx)InChI=1/C16H26O7/c1-15(2)8-3-4-16(5-8,14(15)21)7-22-13-12(20)11(19)10(18)9(6-17)23-13/h8-13,17-20H,3-7H2,1-2H3/t8?,9?,10?,11?,12?,13?,16? Image of MNXM114928
SMILES (mnx)[CH3:1][C:15]1([CH3:2])[CH:8]2[CH2:3][CH2:4][C:16]([CH2:7][O:22][CH:13]3[CH:12]([OH:20])[CH:11]([OH:19])[CH:10]([OH:18])[CH:9]([CH2:6][OH:17])[O:23]3)([CH2:5]2)[C:14]1=[O:21]
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:168123
chebi:168123
WERYFGDRRGZFRG-UHFFFAOYSA-N 		(1S,4R)-10-Hydroxyfenchone glucoside
3,3-dimethyl-1-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]bicyclo[2.2.1]heptan-2-one
hmdb:HMDB0033226
WERYFGDRRGZFRG-UHFFFAOYSA-N 		(1S,4R)-10-Hydroxyfenchone glucoside
3,3-dimethyl-1-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)bicyclo[2.2.1]heptan-2-one

hmdb:HMDB33226 		secondary/obsolete/fantasy identifier