(Q104395102)

English

(5S,6S,8S,10R,13R)-11-ethyl-6,16-dimethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-4,8-diol

group of stereoisomers with the chemical formula C₂₂H₃₅NO₄

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Statements

instance of

group of stereoisomers

0 references

1 reference

377.2566086 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₃₅NO₄

0 references

canonical SMILES

OC1C2CC3C1C(O)(CC2OC)C4CC5C6CN(CC)C4C53C(OC)CC6

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isomeric SMILES

CCN1C[C@@H]2CCC(OC)C34C5C[C@H]6C(O)C5[C@](O)(C[C@@H]6OC)C(CC23)[C@@H]14

0 references

found in taxon

Aconitum forrestii

3 references

stated in

Liwaconitine, a New Diterpenoid Alkaloid from Aconitum forrestii

stated in

Chemical constituents of Aconitum tanguticum

stated in

A new diterpenoid alkaloid from Aconitum hemsleyanum

Aconitum napellus

1 reference

stated in

Diterpenic Alkaloids of Aconitum napellus Roots from Switzerland

Aconitum contortum

1 reference

stated in

Studies on the Alkaloids from Aconitum contortum (I)

Aconitum fischeri

1 reference

stated in

THE ALKALOIDS OF ACONITUM NAPELLUS.

Identifiers

InChI

InChI=1S/C22H35NO4/c1-4-23-10-11-5-6-17(27-3)22-13(11)8-15(20(22)23)21(25)9-16(26-2)12-7-14(22)18(21)19(12)24/h11-20,24-25H,4-10H2,1-3H3/t11-,12+,13?,14?,15?,16-,17?,18?,19?,20+,21-,22?/m0/s1

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InChIKey

VCOQRRVEIUTMFC-OVENPUKKSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VCOQRRVEIUTMFC-OVENPUKKSA-N

(Q104395102)

(5S,6S,8S,10R,13R)-11-ethyl-6,16-dimethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-4,8-diol

Statements

Identifiers

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