(Q104922325)

English

[(1S,3S,6R,8R)-8-hydroxy-3-methyl-5-oxo-2,9-dioxatricyclo[4.3.1.03,8]decan-10-yl]methyl benzoate

group of stereoisomers with the chemical formula C₁₇H₁₈O₆

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Statements

instance of

group of stereoisomers

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subclass of

menthane monoterpenoids

1 reference

inferred from

menthane monoterpenoids

mass

318.110338296 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₇H₁₈O₆

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canonical SMILES

O=C(OCC1C2OC3(O)CC1C(=O)CC3(O2)C)C=4C=CC=CC4

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isomeric SMILES

C[C@]12CC(=O)[C@@H]3C[C@@]1(O)O[C@H](O2)C3COC(=O)c1ccccc1

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found in taxon

Paeonia intermedia

3 references

stated in

Paeonicluside, a new salicylic glycoside from the Greek endemic species Paeonia clusii.

stated in

Chemical constituents isolated from Paeonia lactiflora roots and their neuroprotective activity against oxidative stress in vitro

stated in

Triterpenoid constituents from the roots of Paeonia rockii ssp. rockii.

Paeonia tenuifolia

3 references

stated in

Paeonicluside, a new salicylic glycoside from the Greek endemic species Paeonia clusii.

stated in

Chemical constituents isolated from Paeonia lactiflora roots and their neuroprotective activity against oxidative stress in vitro

stated in

Triterpenoid constituents from the roots of Paeonia rockii ssp. rockii.

Paeonia

1 reference

stated in

Blocking effects of a new component, paeoniflorigenone, in paeony root on neuromuscular junctions of frogs and mice

Identifiers

InChI

InChI=1S/C17H18O6/c1-16-8-13(18)11-7-17(16,20)23-15(22-16)12(11)9-21-14(19)10-5-3-2-4-6-10/h2-6,11-12,15,20H,7-9H2,1H3/t11-,12?,15+,16+,17-/m1/s1

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InChIKey

BANPEMKDTXIFRE-LKGUYIIYSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

BANPEMKDTXIFRE-LKGUYIIYSA-N

1 reference

(Q104922325)

[(1S,3S,6R,8R)-8-hydroxy-3-methyl-5-oxo-2,9-dioxatricyclo[4.3.1.03,8]decan-10-yl]methyl benzoate

Statements

Identifiers

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