(Q104909670)

English

N-[1-[1,15-dihydroxy-3-methoxy-12-(4-methoxyphenyl)-13-phenyl-5,7,11-trioxatetracyclo[10.2.1.02,10.04,8]pentadeca-2,4(8),9-triene-14-carbonyl]pyrrolidin-2-yl]-3-methylbutanamide

group of stereoisomers with the chemical formula C₃₆H₄₀N₂O₉

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

644.27338086 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₆H₄₀N₂O₉

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canonical SMILES

COc1ccc(C23Oc4cc5c(c(OC)c4C(O)(C(C(=O)N4CCCC4NC(=O)CC(C)C)C2c2ccccc2)C3O)OCO5)cc1

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Identifiers

InChI

InChI=1S/C36H40N2O9/c1-20(2)17-27(39)37-26-11-8-16-38(26)33(40)30-28(21-9-6-5-7-10-21)36(22-12-14-23(43-3)15-13-22)34(41)35(30,42)29-24(47-36)18-25-31(32(29)44-4)46-19-45-25/h5-7,9-10,12-15,18,20,26,28,30,34,41-42H,8,11,16-17,19H2,1-4H3,(H,37,39)

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InChIKey

ADLZFRJWHFEYCQ-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

ADLZFRJWHFEYCQ-UHFFFAOYSA-N

(Q104909670)

N-[1-[1,15-dihydroxy-3-methoxy-12-(4-methoxyphenyl)-13-phenyl-5,7,11-trioxatetracyclo[10.2.1.02,10.04,8]pentadeca-2,4(8),9-triene-14-carbonyl]pyrrolidin-2-yl]-3-methylbutanamide

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