(Q110077731)

English

Methyl 27-ethylidene-8,21,40-trimethyl-20,22-dioxa-8,25,30,40-tetrazaundecacyclo[23.11.2.16,17.124,28.01,23.03,21.04,18.07,15.09,14.023,30.031,36]tetraconta-7(15),9,11,13,31,33,35-heptaene-29-carboxylate

group of stereoisomers with the chemical formula C₄₁H₄₈N₄O₄

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

660.367556016 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₄₁H₄₈N₄O₄

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canonical SMILES

O=C(OC)C1N2C=3C=CC=CC3C45CCN6CC(=CC)C1CC6C25OC7(OCC8C9N(C)C(C%10=C(C=%11C=CC=CC%11N%10C)C9)CC8C7C4)C

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found in taxon

Alstonia angustifolia

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stated in

265. The alkaloids of Alstonia barks. Part II. A. macrophylla, wall., A. somersetensis, F. M. Bailey, A. verticillosa, F. Muell., A. villosa, blum

stated in

Alstophyllin, a new indole alkaloid from Alstonia macrophylla Wall

Alstonia macrophylla

2 references

stated in

265. The alkaloids of Alstonia barks. Part II. A. macrophylla, wall., A. somersetensis, F. M. Bailey, A. verticillosa, F. Muell., A. villosa, blum

stated in

Angustimaline, an unusual nitrogenous compound from Alstonia angustifolia

Identifiers

InChI

InChI=1S/C41H48N4O4/c1-6-23-21-44-16-15-40-20-30-26-17-34-36-27(24-11-7-9-13-31(24)43(36)4)18-33(42(34)3)28(26)22-48-39(30,2)49-41(40)35(44)19-25(23)37(38(46)47-5)45(41)32-14-10-8-12-29(32)40/h6-14,25-26,28,30,33-35,37H,15-22H2,1-5H3

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InChIKey

XXNYZYBYNFRERU-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

XXNYZYBYNFRERU-UHFFFAOYSA-N

1 reference

(Q110077731)

Methyl 27-ethylidene-8,21,40-trimethyl-20,22-dioxa-8,25,30,40-tetrazaundecacyclo[23.11.2.16,17.124,28.01,23.03,21.04,18.07,15.09,14.023,30.031,36]tetraconta-7(15),9,11,13,31,33,35-heptaene-29-carboxylate

Statements

Identifiers

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