(Q105148567)

English

[(1S,12S,14R)-9-methoxy-11-oxa-4-azatetracyclo[8.6.1.01,12.06,17]heptadeca-6(17),7,9,15-tetraen-14-yl] (3R)-3-hydroxybutanoate

chemical compound

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instance of

type of chemical entity

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subclass of

(1S,12S,14R)-9-methoxy-11-oxa-4-azatetracyclo[8.6.1.0¹,¹².0⁶,¹⁷]heptadeca-6,8,10(17),15-tetraen-14-yl 3-hydroxybutanoate

1 reference

based on heuristic

inferred from SMILES

(9-Methoxy-11-oxa-4-azatetracyclo[8.6.1.01,12.06,17]heptadeca-6(17),7,9,15-tetraen-14-yl) 3-hydroxybutanoate

1 reference

based on heuristic

inferred from SMILES

mass

359.1732729 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(1S,12S,14R)-9-methoxy-11-oxa-4-azatetracyclo[8.6.1.01,12.06,17]heptadeca-6(17),7,9,15-tetraen-14-yl] (3S)-3-hydroxybutanoate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₅NO₅

0 references

canonical SMILES

O=C(OC1C=CC23C4=C(OC2C1)C(OC)=CC=C4CNCC3)CC(O)C

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isomeric SMILES

COc1ccc2c3c1O[C@H]1C[C@@H](OC(=O)C[C@@H](C)O)C=C[C@@]31CCNC2

0 references

found in taxon

Leucojum vernum

2 references

stated in

Leucovernine and acetylleucovernine, alkaloids from Leucojum vernum

stated in

Leucovernine and acetylleucovernine, alkaloids from Leucojum vernum

Identifiers

InChI

InChI=1S/C20H25NO5/c1-12(22)9-17(23)25-14-5-6-20-7-8-21-11-13-3-4-15(24-2)19(18(13)20)26-16(20)10-14/h3-6,12,14,16,21-22H,7-11H2,1-2H3/t12-,14+,16+,20+/m1/s1

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InChIKey

LABWSUYVTKKYDF-XNGSYYAWSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

LABWSUYVTKKYDF-XNGSYYAWSA-N

1 reference

(Q105148567)

[(1S,12S,14R)-9-methoxy-11-oxa-4-azatetracyclo[8.6.1.01,12.06,17]heptadeca-6(17),7,9,15-tetraen-14-yl] (3R)-3-hydroxybutanoate

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