(Q105034446)

English

dimethyl (1S,9R,16R,17R,18R,21R)-17,18-dihydroxy-2,12-diazahexacyclo[14.2.2.19,12.01,9.03,8.016,21]henicosa-3,5,7,14-tetraene-2,18-dicarboxylate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

dimethyl (1S,9R,16R,21R)-17,18-dihydroxy-2,12-diazahexacyclo[14.2.2.19,12.01,9.03,8.016,21]henicosa-3,5,7,14-tetraene-2,18-dicarboxylate

1 reference

1 reference

426.179086552 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

dimethyl (1R,9R,16R,17S,18S,21S)-17,18-dihydroxy-2,12-diazahexacyclo[14.2.2.19,12.01,9.03,8.016,21]henicosa-3,5,7,14-tetraene-2,18-dicarboxylate

2 references

based on heuristic

inferred from InChIKey

1 reference

1 reference

C₂₃H₂₆N₂O₆

0 references

canonical SMILES

O=C(OC)N1C=2C=CC=CC2C34CCN5CC=CC6(CCC13C(O)(C(=O)OC)C6O)C54

0 references

isomeric SMILES

COC(=O)N1c2ccccc2[C@@]23CCN4CC=C[C@]5(CC[C@]12[C@](O)(C(=O)OC)[C@@H]5O)[C@H]43

0 references

found in taxon

Kopsia teoi

4 references

stated in

Aspidofractinine alkaloids from a new Kopsia species

stated in

Three aspidofractinine-type alkaloids from Kopsia teoi

stated in

Kopsidine A and kopsidine B, two novel indole alkaloids from a Malaysian Kopsia

stated in

Aspidofractinine alkaloids from Kopsia teoi

Identifiers

InChI

InChI=1S/C23H26N2O6/c1-30-18(27)23(29)17(26)20-8-5-12-24-13-11-21(16(20)24)14-6-3-4-7-15(14)25(19(28)31-2)22(21,23)10-9-20/h3-8,16-17,26,29H,9-13H2,1-2H3/t16-,17+,20-,21+,22-,23+/m0/s1

0 references

InChIKey

HVUPNDMRYTUMME-WYACCEDRSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

1 reference

(Q105034446)

dimethyl (1S,9R,16R,17R,18R,21R)-17,18-dihydroxy-2,12-diazahexacyclo[14.2.2.19,12.01,9.03,8.016,21]henicosa-3,5,7,14-tetraene-2,18-dicarboxylate

Statements

Identifiers

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