(1S,2S,4R,8S)-p-Menthane-1,2,8,9-tetrol 2-glucoside (CHEBI:168093)

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CHEBI:168093 - (1S,2S,4R,8S)-p-Menthane-1,2,8,9-tetrol 2-glucoside

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ChEBI ID	CHEBI:168093
ChEBI Name	(1S,2S,4R,8S)-p-Menthane-1,2,8,9-tetrol 2-glucoside
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C16H30O9
Net Charge	0
Average Mass	366.407
Monoisotopic Mass	366.18898
SMILES	CC(O)(CO)C1CCC(C)(O)C(OC2OC(CO)C(O)C(O)C2O)C1
InChI	InChI=1S/C16H30O9/c1-15(22)4-3-8(16(2,23)7-18)5-10(15)25-14-13(21)12(20)11(19)9(6-17)24-14/h8-14,17-23H,3-7H2,1-2H3
InChIKey	HKSOQIVAOUMKMF-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Malus domestica (ncbitaxon:3750)	exocarp (BTO:0000733)	MetaboLights (MTBLS2384)	Strain: Malus x domestica Borkh. cv. Ruixue

ChEBI Ontology

Outgoing Relation(s)
	(1S,2S,4R,8S)-p-Menthane-1,2,8,9-tetrol 2-glucoside (CHEBI:168093) is a terpene glycoside (CHEBI:61777)

IUPAC Name
2-[5-(1,2-dihydroxypropan-2-yl)-2-hydroxy-2-methylcyclohexyl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

Manual Xrefs	Databases
HMDB0039975	HMDB