(Q104667620)

English

(1S,11R,12R)-1-hydroxy-21-methoxy-12-(4-methoxyphenyl)-11-phenyl-13,17,19-trioxa-3,8-diazahexacyclo[10.10.0.02,10.04,8.014,22.016,20]docosa-2(10),3,14,16(20),21-pentaen-9-one

chemical compound

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instance of

type of chemical entity

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subclass of

1-hydroxy-21-methoxy-12-(4-methoxyphenyl)-11-phenyl-13,17,19-trioxa-3,8-diazahexacyclo[10.10.0.0²,¹⁰.0⁴,⁸.0¹⁴,²².0¹⁶,²⁰]docosa-2(10),3,14,16(20),21-pentaen-9-one

1 reference

based on heuristic

inferred from SMILES

mass

538.174001172 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₁H₂₆N₂O₇

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canonical SMILES

O=C1C2=C(N=C3N1CCC3)C4(O)C=5C(OC4(C6=CC=C(OC)C=C6)C2C=7C=CC=CC7)=CC=8OCOC8C5OC

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isomeric SMILES

COc1ccc([C@@]23Oc4cc5c(c(OC)c4[C@]2(O)c2nc4n(c(=O)c2[C@H]3c2ccccc2)CCC4)OCO5)cc1

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found in taxon

Aglaia roxburghiana

1 reference

stated in

Insecticidal natural products: new rocaglamide derivatives fromAglaia roxburghiana

Aglaia elaeagnoidea

1 reference

stated in

Insecticidal natural products: new rocaglamide derivatives fromAglaia roxburghiana

Identifiers

InChI

InChI=1S/C31H26N2O7/c1-36-19-12-10-18(11-13-19)31-24(17-7-4-3-5-8-17)23-28(32-22-9-6-14-33(22)29(23)34)30(31,35)25-20(40-31)15-21-26(27(25)37-2)39-16-38-21/h3-5,7-8,10-13,15,24,35H,6,9,14,16H2,1-2H3/t24-,30+,31+/m1/s1

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InChIKey

FESMFICXVFCFJD-GTTXMTDLSA-N

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1 reference

17 September 2022

inferred from InChIKey

1 reference

(Q104667620)

(1S,11R,12R)-1-hydroxy-21-methoxy-12-(4-methoxyphenyl)-11-phenyl-13,17,19-trioxa-3,8-diazahexacyclo[10.10.0.02,10.04,8.014,22.016,20]docosa-2(10),3,14,16(20),21-pentaen-9-one

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