(Q105177941)

English

6-[3-(3-Hydroxybenzoyl)oxybenzoyl]oxy-7-methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid

group of stereoisomers with the chemical formula C₃₀H₃₂O₁₄

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Statements

instance of

group of stereoisomers

0 references

1 reference

1 reference

616.179205704 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₀H₃₂O₁₄

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canonical SMILES

O=C(O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C3C1CC(OC(=O)C=4C=CC=C(OC(=O)C=5C=CC=C(O)C5)C4)C3C

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found in taxon

Swertia japonica

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stated in

Senburiside II, a New Iridoid Glucoside from Swertia japonica

Identifiers

InChI

InChI=1S/C30H32O14/c1-13-20(42-28(39)15-5-3-7-17(9-15)41-27(38)14-4-2-6-16(32)8-14)10-18-19(26(36)37)12-40-29(22(13)18)44-30-25(35)24(34)23(33)21(11-31)43-30/h2-9,12-13,18,20-25,29-35H,10-11H2,1H3,(H,36,37)

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InChIKey

NEICHVDTJPKDLU-UHFFFAOYSA-N

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1 reference

17 September 2022

inferred from InChIKey

(Q105177941)

6-[3-(3-Hydroxybenzoyl)oxybenzoyl]oxy-7-methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid

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Identifiers

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