(Q105176455)

English

[(1R,2R,4S,5R,7R,8R,9R,10R,13R,16S,17R)-11-ethyl-7,16-dihydroxy-13-methyl-6-methylidene-11-azahexacyclo[7.7.2.15,8.01,10.02,8.013,17]nonadecan-4-yl] acetate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

(11-Ethyl-7,16-dihydroxy-13-methyl-6-methylidene-11-azahexacyclo[7.7.2.15,8.01,10.02,8.013,17]nonadecan-4-yl) acetate

1 reference

based on heuristic

inferred from SMILES

mass

401.2566086 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₄H₃₅NO₄

0 references

canonical SMILES

O=C(OC1CC2C3(CC1C(=C)C3O)C4CC5C6(C)CN(CC)C4C52C(O)CC6)C

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isomeric SMILES

C=C1[C@H]2C[C@]3([C@@H]1O)[C@H]1C[C@@H]4[C@@]5(C)CC[C@H](O)[C@@]4([C@@H]1N(CC)C5)[C@@H]3C[C@@H]2OC(C)=O

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found in taxon

Aconitum karakolicum

1 reference

stated in

Acetylnapelline — A new alkaloid from Aconitum karakolicum

Aconitum barbatum

1 reference

stated in

Alkaloids fromAconitum barbatumvar.puberulum

Identifiers

InChI

InChI=1S/C24H35NO4/c1-5-25-11-22(4)7-6-19(27)24-17(22)8-15(20(24)25)23-10-14(12(2)21(23)28)16(9-18(23)24)29-13(3)26/h14-21,27-28H,2,5-11H2,1,3-4H3/t14-,15+,16+,17-,18-,19+,20-,21-,22+,23+,24+/m1/s1

0 references

InChIKey

NAPCYARSWDECJP-ORDWSRHTSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

NAPCYARSWDECJP-ORDWSRHTSA-N

(Q105176455)

[(1R,2R,4S,5R,7R,8R,9R,10R,13R,16S,17R)-11-ethyl-7,16-dihydroxy-13-methyl-6-methylidene-11-azahexacyclo[7.7.2.15,8.01,10.02,8.013,17]nonadecan-4-yl] acetate

Statements

Identifiers

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