(Q104946393)

English

methyl 4-hydroxy-3-[(2R,3R)-6-hydroxy-2-(2-hydroxypropan-2-yl)-4-methoxy-7-(3-phenylpropanoyl)-2,3,6,7-tetrahydro-1-benzofuran-3-yl]benzoate

group of stereoisomers with the chemical formula C₂₉H₃₂O₈

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

508.209717984 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₉H₃₂O₈

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canonical SMILES

O=C(OC)C1=CC=C(O)C(=C1)C2C=3C(OC)=CC(O)C(C(=O)CCC=4C=CC=CC4)C3OC2C(O)(C)C

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isomeric SMILES

COC(=O)c1ccc(O)c([C@@H]2C3=C(O[C@H]2C(C)(C)O)C(C(=O)CCc2ccccc2)C(O)C=C3OC)c1

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found in taxon

Piper aduncum

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stated in

Benzoic acid derivatives from Piper species and their fungitoxic activity against Cladosporium cladosporioides and C. sphaerospermum

Identifiers

InChI

InChI=1S/C29H32O8/c1-29(2,34)27-23(18-14-17(28(33)36-4)11-13-19(18)30)25-22(35-3)15-21(32)24(26(25)37-27)20(31)12-10-16-8-6-5-7-9-16/h5-9,11,13-15,21,23-24,27,30,32,34H,10,12H2,1-4H3/t21?,23-,24?,27-/m1/s1

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InChIKey

BUYHVQYKLADDJT-DKVGFKEGSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

BUYHVQYKLADDJT-DKVGFKEGSA-N

(Q104946393)

methyl 4-hydroxy-3-[(2R,3R)-6-hydroxy-2-(2-hydroxypropan-2-yl)-4-methoxy-7-(3-phenylpropanoyl)-2,3,6,7-tetrahydro-1-benzofuran-3-yl]benzoate

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