(12S)-18,19-dimethoxy-5,7-dioxa-13-azapentacyclo[10.7.1.02,10.04,8.016,20]icosa-1(20),2,4(8),9,16,18-hexaene (Q105136431)

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chemical compound

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Language	Label	Description	Also known as
English	(12S)-18,19-dimethoxy-5,7-dioxa-13-azapentacyclo[10.7.1.02,10.04,8.016,20]icosa-1(20),2,4(8),9,16,18-hexaene	chemical compound

Statements

instance of

type of chemical entity

0 references

subclass of

aporphine alkaloids

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mass

325.131408088 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₉H₁₉NO₄

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canonical SMILES

O(C=1C=C2C3=C(C1OC)C4=CC=5OCOC5C=C4CC3NCC2)C

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isomeric SMILES

COc1cc2c3c(c1OC)-c1cc4c(cc1C[C@@H]3NCC2)OCO4

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found in taxon

Cyclea atjehensis

1 reference

stated in

(+)-N-Formylnornantenine, a New Aporphine Alkaloid from Cyclea atjehensis

Siparuna grandiflora

1 reference

stated in

Alkaloids of Siparuna tonduziana

Xylopia holtzii

2 references

stated in

Secondary and tertiary isoquinoline alkaloids from Xylopia parviflora

stated in

Secondary and tertiary isoquinoline alkaloids from Xylopia parviflora

Laureliopsis philippiana

1 reference

stated in

Additional alkaloids from Laurelia philippiana and L. novae-zelandiae

Identifiers

InChI

InChI=1S/C19H19NO4/c1-21-16-6-10-3-4-20-13-5-11-7-14-15(24-9-23-14)8-12(11)18(17(10)13)19(16)22-2/h6-8,13,20H,3-5,9H2,1-2H3/t13-/m0/s1

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InChIKey

JWXKBCGJLCEZTJ-ZDUSSCGKSA-N

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CAS Registry Number

15401-66-8

1 reference

stated in

CAS (formerly Chemical Abstracts Service)

retrieved

25 January 2022

PubChem CID

14395308

1 reference

stated in

PubChem

retrieved

17 September 2022

based on heuristic

inferred from InChIKey

UniChem compound ID

53123299

1 reference

stated in

UniChem

 

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