(Q110185651)

English

3,4,5-trimethoxy-10-oxo-11,18,20-trioxapentacyclo[13.7.0.0²,⁷.0⁹,¹³.0¹⁷,²¹]docosa-1(22),2(7),3,5,15,17(21)-hexaen-14-yl (2Z)-2-methylbut-2-enoate

group of stereoisomers with the chemical formula C₂₇H₂₈O₉

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Statements

group of stereoisomers

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chemical compound

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496.1733324759999 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₇H₂₈O₉

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canonical SMILES

O=C(OC1C2=CC=3OCOC3C=C2C=4C(OC)=C(OC)C(OC)=CC4CC5C(=O)OCC15)C(=CC)C

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isomeric SMILES

C/C=C(/C)C(=O)OC1c2cc3c(cc2-c2c(cc(OC)c(OC)c2OC)CC2C(=O)OCC21)OCO3

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based on heuristic

inferred from InChI

Identifiers

InChI=1S/C27H28O9/c1-6-13(2)26(28)36-23-16-10-20-19(34-12-35-20)9-15(16)22-14(7-17-18(23)11-33-27(17)29)8-21(30-3)24(31-4)25(22)32-5/h6,8-10,17-18,23H,7,11-12H2,1-5H3/b13-6-

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IIEOCQLKEFBZIS-MLPAPPSSSA-N

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1 reference

matched by identifier from

IIEOCQLKEFBZIS-MLPAPPSSSA-N

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