(Q105297649)

English

[6-[[2-(Benzoyloxymethyl)-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.02,5.03,8]decan-3-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methyl 4-methoxybenzoate

group of stereoisomers with the chemical formula C₃₁H₃₄O₁₃

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Statements

group of stereoisomers

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pinane monoterpenoid

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pinane monoterpenoid

614.199941148 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₁H₃₄O₁₃

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canonical SMILES

O=C(OCC1OC(OC23CC4C5(O)OC(OC2(C)C5)C43COC(=O)C=6C=CC=CC6)C(O)C(O)C1O)C7=CC=C(OC)C=C7

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Paeonia × suffruticosa

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Monoterpene glycosides from Paeonia suffruticosa

Identifiers

InChI=1S/C31H34O13/c1-28-14-30(37)20-12-31(28,29(20,27(43-28)44-30)15-40-25(36)16-6-4-3-5-7-16)42-26-23(34)22(33)21(32)19(41-26)13-39-24(35)17-8-10-18(38-2)11-9-17/h3-11,19-23,26-27,32-34,37H,12-15H2,1-2H3

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VVGAQVZLAQTOFF-UHFFFAOYSA-N

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1 reference

6 January 2023

based on heuristic

inferred from InChIKey

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