(Q105372789)

English

1-{2-[1-(acetyloxy)ethyl]-2-hydroxy-1-methyl-5-oxocyclopentyl}-2-(6-hydroxy-8a-methyl-2-oxo-1,3,5,6,7,8-hexahydronaphthalen-1-yl)ethyl (2E)-3-phenylprop-2-enoate

group of stereoisomers with the chemical formula C₃₂H₄₀O₈

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

552.27231824 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₂H₄₀O₈

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canonical SMILES

O=C(OC(CC1C(=O)CC=C2CC(O)CCC21C)C3(C(=O)CCC3(O)C(OC(=O)C)C)C)C=CC=4C=CC=CC4

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isomeric SMILES

CC(=O)OC(C)C1(O)CCC(=O)C1(C)C(CC1C(=O)CC=C2CC(O)CCC21C)OC(=O)/C=C/c1ccccc1

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found in taxon

Cynanchum gracillimum

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stated in

Studies on the Constituents of Adelostemma gracillimum

Identifiers

InChI

InChI=1S/C32H40O8/c1-20(39-21(2)33)32(38)17-15-27(36)31(32,4)28(40-29(37)13-10-22-8-6-5-7-9-22)19-25-26(35)12-11-23-18-24(34)14-16-30(23,25)3/h5-11,13,20,24-25,28,34,38H,12,14-19H2,1-4H3/b13-10+

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InChIKey

ZDVZPXOYLMPQQR-JLHYYAGUSA-N

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(Q105372789)

1-{2-[1-(acetyloxy)ethyl]-2-hydroxy-1-methyl-5-oxocyclopentyl}-2-(6-hydroxy-8a-methyl-2-oxo-1,3,5,6,7,8-hexahydronaphthalen-1-yl)ethyl (2E)-3-phenylprop-2-enoate

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