(Q105290009)

English

(2S)-N-[(2S)-1-[(1R,9R,10S,11R,12S)-9-(3,4-dimethoxyphenyl)-1,12-dihydroxy-3,5-dimethoxy-10-phenyl-8-oxatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-11-carbonyl]pyrrolidin-2-yl]-2-hydroxy-2-methylbutanamide

chemical compound

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instance of

type of chemical entity

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subclass of

N-[1-[9-(3,4-dimethoxyphenyl)-1,12-dihydroxy-3,5-dimethoxy-10-phenyl-8-oxatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-11-carbonyl]pyrrolidin-2-yl]-2-hydroxy-2-methylbutanamide

1 reference

based on heuristic

inferred from SMILES

mass

676.299595608 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(2R)-N-[(2S)-1-[(1R,9R,10S,11R,12R)-9-(3,4-dimethoxyphenyl)-1,12-dihydroxy-3,5-dimethoxy-10-phenyl-8-oxatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-11-carbonyl]pyrrolidin-2-yl]-2-hydroxy-2-methylbutanamide

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₇H₄₄N₂O₁₀

0 references

canonical SMILES

CCC(C)(O)C(=O)NC1CCCN1C(=O)C1C(c2ccccc2)C2(c3ccc(OC)c(OC)c3)Oc3cc(OC)cc(OC)c3C1(O)C2O

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isomeric SMILES

CC[C@](C)(O)C(=O)N[C@@H]1CCCN1C(=O)[C@@H]1[C@@H](c2ccccc2)[C@]2(c3ccc(OC)c(OC)c3)Oc3cc(OC)cc(OC)c3[C@@]1(O)[C@@H]2O

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found in taxon

Aglaia odorata

1 reference

stated in

An insecticidal rocaglamide derivatives and related compounds from Aglaia odorata (Meliaceae)

Identifiers

InChI

InChI=1S/C37H44N2O10/c1-7-35(2,43)34(42)38-28-14-11-17-39(28)32(40)31-29(21-12-9-8-10-13-21)37(22-15-16-24(46-4)25(18-22)47-5)33(41)36(31,44)30-26(48-6)19-23(45-3)20-27(30)49-37/h8-10,12-13,15-16,18-20,28-29,31,33,41,43-44H,7,11,14,17H2,1-6H3,(H,38,42)/t28-,29+,31-,33-,35-,36-,37-/m0/s1

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InChIKey

VNXFYHIODJMICD-ZAQFQLPFSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VNXFYHIODJMICD-ZAQFQLPFSA-N

(Q105290009)

(2S)-N-[(2S)-1-[(1R,9R,10S,11R,12S)-9-(3,4-dimethoxyphenyl)-1,12-dihydroxy-3,5-dimethoxy-10-phenyl-8-oxatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-11-carbonyl]pyrrolidin-2-yl]-2-hydroxy-2-methylbutanamide

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