(Q104909667)

English

N-[(2R)-1-[(1R,12R,13S,14R,15S)-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

chemical compound

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type of chemical entity

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subclass of

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

1 reference

1 reference

644.27338086 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

N-[(2R)-1-[(1R,12R,13S,14R,15R)-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

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₆H₄₀N₂O₉

0 references

canonical SMILES

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

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isomeric SMILES

COc1ccc([C@]23Oc4cc5c(c(OC)c4[C@](O)([C@H](C(=O)N4CCC[C@@H]4NC(=O)CC(C)C)[C@H]2c2ccccc2)[C@@H]3O)OCO5)cc1

0 references

found in taxon

Aglaia edulis

1 reference

stated in

Cytotoxic flavaglines and bisamides from Aglaia edulis.

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)/t26-,28-,30+,34+,35+,36+/m1/s1

0 references

InChIKey

ADLZFRJWHFEYCQ-BQXWYBIPSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

ADLZFRJWHFEYCQ-BQXWYBIPSA-N

(Q104909667)

N-[(2R)-1-[(1R,12R,13S,14R,15S)-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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