(Q105228775)

English

(3R,4'R,6'R,7'S,8'aR)-7'-[(1Z)-1,3-dimethoxy-3-oxoprop-1-en-2-yl]-6'-ethyl-4'-methyl-3',5',6',7',8',8'a-hexahydro-2'H-spiro[indole-3,1'-indolizin]-4'-ium-2-olate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

mitraphylline-type alkaloid

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mass

398.22055744 dalton

1 reference

1 reference

C₂₃H₃₀N₂O₄

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canonical SMILES

O=C(OC)C(=COC)C1CC2C3(C([O-])=NC=4C=CC=CC43)CC[N+]2(C)CC1CC

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isomeric SMILES

CC[C@H]1C[N@@+]2(C)CC[C@]3(C([O-])=Nc4ccccc43)[C@H]2C[C@@H]1/C(=C/OC)C(=O)OC

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found in taxon

Uncaria macrophylla

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stated in

Macrophyllionium and macrophyllines A and B, oxindole alkaloids from Uncaria macrophylla

Identifiers

InChI

InChI=1S/C23H30N2O4/c1-5-15-13-25(2)11-10-23(18-8-6-7-9-19(18)24-22(23)27)20(25)12-16(15)17(14-28-3)21(26)29-4/h6-9,14-16,20H,5,10-13H2,1-4H3/b17-14-/t15-,16-,20+,23+,25+/m0/s1

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InChIKey

QVNYBASBMONTJV-VSDFPOAWSA-N

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1 reference

17 September 2022

inferred from InChIKey

1 reference

(Q105228775)

(3R,4'R,6'R,7'S,8'aR)-7'-[(1Z)-1,3-dimethoxy-3-oxoprop-1-en-2-yl]-6'-ethyl-4'-methyl-3',5',6',7',8',8'a-hexahydro-2'H-spiro[indole-3,1'-indolizin]-4'-ium-2-olate

Statements

Identifiers

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