(Q110187966)

English

[(1R,3S,5S,6S,7R)-6-hydroxy-8-methyl-7-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]oxy-8-azabicyclo[3.2.1]octan-3-yl] (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate

chemical compound

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Statements

instance of

type of chemical entity

0 references

1 reference

613.252311068 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(1R,3S,5S,6R,7S)-6-hydroxy-8-methyl-7-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]oxy-8-azabicyclo[3.2.1]octan-3-yl] (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₂H₃₉NO₁₁

0 references

canonical SMILES

O=C(OC1CC2N(C)C(C1)C(OC(=O)C=CC3=CC(OC)=C(OC)C(OC)=C3)C2O)C=CC4=CC(OC)=C(OC)C(OC)=C4

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isomeric SMILES

COc1cc(/C=C/C(=O)O[C@H]2C[C@H]3[C@H](O)[C@H](OC(=O)/C=C/c4cc(OC)c(OC)c(OC)c4)[C@@H](C2)N3C)cc(OC)c1OC

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found in taxon

Erythroxylum pervillei

1 reference

stated in

Modulation of the multidrug-resistance phenotype by new tropane alkaloid aromatic esters from Erythroxylum pervillei

Identifiers

InChI

InChI=1S/C32H39NO11/c1-33-21-16-20(43-27(34)10-8-18-12-23(37-2)31(41-6)24(13-18)38-3)17-22(33)30(29(21)36)44-28(35)11-9-19-14-25(39-4)32(42-7)26(15-19)40-5/h8-15,20-22,29-30,36H,16-17H2,1-7H3/b10-8+,11-9+/t20-,21-,22+,29-,30+/m0/s1

0 references

InChIKey

GYERRJFXENPCTB-XPZAWVMKSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

GYERRJFXENPCTB-XPZAWVMKSA-N

1 reference

(Q110187966)

[(1R,3S,5S,6S,7R)-6-hydroxy-8-methyl-7-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]oxy-8-azabicyclo[3.2.1]octan-3-yl] (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate

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