(Q105163637)

English

(8,9-Dihydroxy-4,6,16,18-tetramethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-13-yl)methyl 2-(3-methyl-2,5-dioxopyrrolidin-1-yl)benzoate

group of stereoisomers with the chemical formula C₃₅H₄₆N₂O₁₀

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Statements

instance of

group of stereoisomers

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1 reference

1 reference

654.315245672 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₅H₄₆N₂O₁₀

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canonical SMILES

O=C(OCC12CNC3C4(O)C(OC)C1C3(C(OC)CC2)C5CC6C(OC)CC4(O)C5C6OC)C=7C=CC=CC7N8C(=O)CC(C8=O)C

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found in taxon

Aconitum cochleare

1 reference

stated in

Diterpenoid Alkaloids from the Roots of Aconitum cochleare

Identifiers

InChI

InChI=1S/C35H46N2O10/c1-17-12-24(38)37(29(17)39)21-9-7-6-8-18(21)30(40)47-16-32-11-10-23(44-3)34-20-13-19-22(43-2)14-33(41,25(20)26(19)45-4)35(42,31(34)36-15-32)28(46-5)27(32)34/h6-9,17,19-20,22-23,25-28,31,36,41-42H,10-16H2,1-5H3

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InChIKey

MGXUHQQWZVYZOY-UHFFFAOYSA-N

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2 references

2 January 2023

inferred from InChIKey

matched by identifier from

InChIKey

MGXUHQQWZVYZOY-UHFFFAOYSA-N

(Q105163637)

(8,9-Dihydroxy-4,6,16,18-tetramethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-13-yl)methyl 2-(3-methyl-2,5-dioxopyrrolidin-1-yl)benzoate

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