(Q104170234)

English

[20,22,23-Triacetyloxy-21-(acetyloxymethyl)-25,26-dihydroxy-3,15,26-trimethyl-6,16-dioxo-2,5,17-trioxa-11-azapentacyclo[16.7.1.01,21.03,24.07,12]hexacosa-7(12),8,10-trien-19-yl] benzoate

group of stereoisomers with the chemical formula C₄₁H₄₇NO₁₇

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Statements

instance of

group of stereoisomers

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subclass of

eudesmane sesquiterpenoid

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inferred from

eudesmane sesquiterpenoid

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1 reference

825.284399044 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₄₁H₄₇NO₁₇

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canonical SMILES

O=C1OCC2(OC34C(O)C2C(OC(=O)C)C(OC(=O)C)C4(COC(=O)C)C(OC(=O)C)C(OC(=O)C=5C=CC=CC5)C(OC(=O)C(C)CCC6=NC=CC=C16)C3(O)C)C

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found in taxon

Tripterygium wilfordii

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stated in

CHEMICAL CONSTITUENTS

stated in

Sesquiterpene alkaloids from Tripterygiumwilfordii (Hook): a nuclear magnetic resonance study of 1-desacetylwilfordine, 1-desacetylwilfortrine, and 2-debenzoyl-2-nicotinoylwilforine

stated in

Alkaloids from Tripterygium wilfordii Hook. — Wilforine and Wilfordine1,2

Peritassa campestris

1 reference

stated in

Studies towards the detection and identification of sesquiterpene pyridine alkaloids in Peritassa campestris by mass spectrometry

Identifiers

InChI

InChI=1S/C41H47NO17/c1-20-15-16-27-26(14-11-17-42-27)37(50)53-18-38(6)28-29(54-22(3)44)33(55-23(4)45)40(19-52-21(2)43)34(56-24(5)46)30(57-36(49)25-12-9-8-10-13-25)32(58-35(20)48)39(7,51)41(40,59-38)31(28)47/h8-14,17,20,28-34,47,51H,15-16,18-19H2,1-7H3

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InChIKey

KFDGOKBQZFYGJQ-UHFFFAOYSA-N

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1 reference

17 September 2022

inferred from InChIKey

(Q104170234)

[20,22,23-Triacetyloxy-21-(acetyloxymethyl)-25,26-dihydroxy-3,15,26-trimethyl-6,16-dioxo-2,5,17-trioxa-11-azapentacyclo[16.7.1.01,21.03,24.07,12]hexacosa-7(12),8,10-trien-19-yl] benzoate

Statements

Identifiers

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