(Q104909663)

English

methyl (1S,12R,19R,20R,21R,24R)-20,21-dihydroxy-5,7-dioxa-2,15-diazaheptacyclo[17.2.2.112,15.01,12.03,11.04,8.019,24]tetracosa-3(11),4(8),9,17-tetraene-21-carboxylate

chemical compound

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Statements

instance of

type of chemical entity

0 references

1 reference

412.163436488 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₂₄N₂O₆

0 references

canonical SMILES

O=C(OC)C1(O)C(O)C23C=CCN4CCC5(C6=CC=C7OCOC7=C6NC15CC2)C43

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isomeric SMILES

COC(=O)[C@]1(O)[C@H](O)[C@@]23C=CCN4CC[C@@]5(c6ccc7c(c6N[C@]15CC2)OCO7)[C@@H]43

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found in taxon

Kopsia singapurensis

1 reference

stated in

Biologically active aspidofractinine alkaloids from Kopsia singapurensis

Identifiers

InChI

InChI=1S/C22H24N2O6/c1-28-18(26)22(27)17(25)19-5-2-9-24-10-8-20(16(19)24)12-3-4-13-15(30-11-29-13)14(12)23-21(20,22)7-6-19/h2-5,16-17,23,25,27H,6-11H2,1H3/t16-,17+,19-,20+,21-,22+/m0/s1

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InChIKey

ADLOIJBRZNBATQ-BPORMVBISA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

ADLOIJBRZNBATQ-BPORMVBISA-N

1 reference

(Q104909663)

methyl (1S,12R,19R,20R,21R,24R)-20,21-dihydroxy-5,7-dioxa-2,15-diazaheptacyclo[17.2.2.112,15.01,12.03,11.04,8.019,24]tetracosa-3(11),4(8),9,17-tetraene-21-carboxylate

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Identifiers

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