CID 85382765

(4s,6r)-p-mentha-1,8-diene-6,7-diol 7-glucoside

Structural Information

Molecular Formula
C16H26O7
SMILES
CC(=C)C1CC=C(C(C1)O)COC2C(C(C(C(O2)CO)O)O)O
InChI
InChI=1S/C16H26O7/c1-8(2)9-3-4-10(11(18)5-9)7-22-16-15(21)14(20)13(19)12(6-17)23-16/h4,9,11-21H,1,3,5-7H2,2H3
InChIKey
FOPFIQVPEVWICE-UHFFFAOYSA-N
Compound name
2-(hydroxymethyl)-6-[(6-hydroxy-4-prop-1-en-2-ylcyclohexen-1-yl)methoxy]oxane-3,4,5-triol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

330.16785 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 331.17513 176.8
[M+Na]+ 353.15707 183.7
[M+NH4]+ 348.20167 180.3
[M+K]+ 369.13101 182.2
[M-H]- 329.16057 176.8
[M+Na-2H]- 351.14252 175.0
[M]+ 330.16730 177.1
[M]- 330.16840 177.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

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No patent data available for this compound.