(Q104992423)

English

dimethyl (1S,2R,6R,17S,18R,19R,21S,23S)-18-hydroxy-23-methoxy-11,13,20-trioxa-3,16-diazaoctacyclo[15.6.2.01,19.02,6.03,21.06,17.07,15.010,14]pentacosa-7(15),8,10(14)-triene-16,18-dicarboxylate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

Dimethyl 18-hydroxy-23-methoxy-11,13,20-trioxa-3,16-diazaoctacyclo[15.6.2.01,19.02,6.03,21.06,17.07,15.010,14]pentacosa-7(15),8,10(14)-triene-16,18-dicarboxylate

1 reference

based on heuristic

inferred from SMILES

mass

500.179480476 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₅H₂₈N₂O₉

0 references

canonical SMILES

O=C(OC)N1C2=C3OCOC3=CC=C2C45CCN6C7OC8C(O)(C(=O)OC)C15CCC8(C(OC)C7)C64

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isomeric SMILES

COC(=O)N1c2c(ccc3c2OCO3)[C@@]23CCN4[C@@H]5C[C@H](OC)[C@]6(CC[C@]12[C@](O)(C(=O)OC)[C@@H]6O5)[C@H]43

0 references

found in taxon

Kopsia singapurensis

1 reference

stated in

Alkaloids of Kopsia lapidilecta

Identifiers

InChI

InChI=1S/C25H28N2O9/c1-31-14-10-15-26-9-8-23-12-4-5-13-17(35-11-34-13)16(12)27(21(29)33-3)24(23)7-6-22(14,18(23)26)19(36-15)25(24,30)20(28)32-2/h4-5,14-15,18-19,30H,6-11H2,1-3H3/t14-,15-,18-,19+,22+,23+,24-,25+/m0/s1

0 references

InChIKey

FATPEVYALCFKAP-RNXQNILHSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

FATPEVYALCFKAP-RNXQNILHSA-N

(Q104992423)

dimethyl (1S,2R,6R,17S,18R,19R,21S,23S)-18-hydroxy-23-methoxy-11,13,20-trioxa-3,16-diazaoctacyclo[15.6.2.01,19.02,6.03,21.06,17.07,15.010,14]pentacosa-7(15),8,10(14)-triene-16,18-dicarboxylate

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Identifiers

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