(Q110187596)

English

(12R,13S,14S)-18,19-dimethoxy-13,14-dimethyl-20-oxo-3,6,8-trioxapentacyclo[9.9.1.0¹,¹⁶.0⁴,²¹.0⁵,⁹]henicosa-4,9,11(21),16,18-pentaen-12-yl benzoate

group of stereoisomers with the chemical formula C₂₉H₂₈O₈

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Statements

group of stereoisomers

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chemical compound

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504.17841785599995 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₂₉H₂₈O₈

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canonical SMILES

O=C(OC1C2=CC=3OCOC3C=4OCC5(C(=O)C(OC)=C(OC)C=C5CC(C)C1C)C42)C=6C=CC=CC6

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isomeric SMILES

COC1=C(OC)C(=O)C23COc4c5c(cc(c42)[C@H](OC(=O)c2ccccc2)[C@@H](C)[C@@H](C)CC3=C1)OCO5

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Identifiers

InChI=1S/C29H28O8/c1-15-10-18-11-20(32-3)25(33-4)27(30)29(18)13-34-26-22(29)19(12-21-24(26)36-14-35-21)23(16(15)2)37-28(31)17-8-6-5-7-9-17/h5-9,11-12,15-16,23H,10,13-14H2,1-4H3/t15-,16-,23+,29?/m0/s1

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RMKQIKRRIGHWHR-WABQJXHHSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

RMKQIKRRIGHWHR-WABQJXHHSA-N

UniChem compound ID

1 reference

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