(Q105339994)

English

[(7R,8R)-7-(3-methylbut-2-enoyloxy)-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (2R)-2,3-dihydroxy-2-(1-hydroxyethyl)-3-methylbutanoate

group of stereoisomers with the chemical formula C₂₀H₃₁NO₇

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Statements

instance of

group of stereoisomers

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subclass of

pyrrolizidine alkaloid

1 reference

inferred from

pyrrolizidine alkaloid

mass

397.210052332 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₃₁NO₇

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canonical SMILES

O=C(OC1CCN2CC=C(COC(=O)C(O)(C(O)C)C(O)(C)C)C21)C=C(C)C

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isomeric SMILES

CC(C)=CC(=O)O[C@@H]1CCN2CC=C(COC(=O)[C@@](O)(C(C)O)C(C)(C)O)[C@H]12

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found in taxon

Onosma leptantha

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stated in

Pyrrolizidine Alkaloids from Onosma leptantha.

Echium vulgare

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stated in

Pyrrolizidine and tetrahydroisoquinoline alkaloids from Echium humile

Identifiers

InChI

InChI=1S/C20H31NO7/c1-12(2)10-16(23)28-15-7-9-21-8-6-14(17(15)21)11-27-18(24)20(26,13(3)22)19(4,5)25/h6,10,13,15,17,22,25-26H,7-9,11H2,1-5H3/t13?,15-,17-,20+/m1/s1

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InChIKey

XQRINBJLKOBTMI-ZWRFSBCPSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

XQRINBJLKOBTMI-ZWRFSBCPSA-N

1 reference

(Q105339994)

[(7R,8R)-7-(3-methylbut-2-enoyloxy)-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (2R)-2,3-dihydroxy-2-(1-hydroxyethyl)-3-methylbutanoate

Statements

Identifiers

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