(Q105143352)

English

(1R,9R,10S,12R,13E,16S,17S,18S)-13-ethylidene-8-methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2(7),3,5-triene-6,18-diol

chemical compound

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Statements

instance of

group of stereoisomers

0 references

subclass of

ajmaline alkaloid

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mass

324.183778008 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₄N₂O₂

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canonical SMILES

OC1=CC=CC2=C1N(C)C3C4N5CC(=CC)C(C4)C6C(O)C23CC56

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isomeric SMILES

C/C=C1/CN2[C@H]3C[C@@]45c6cccc(O)c6N(C)[C@H]4[C@@H]2C[C@@H]1[C@@H]3[C@@H]5O

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found in taxon

Rauvolfia media

1 reference

stated in

Indole alkaloids from Rauvolfia media

Identifiers

InChI

InChI=1S/C20H24N2O2/c1-3-10-9-22-13-7-11(10)16-14(22)8-20(19(16)24)12-5-4-6-15(23)17(12)21(2)18(13)20/h3-6,11,13-14,16,18-19,23-24H,7-9H2,1-2H3/b10-3-/t11-,13-,14-,16-,18-,19-,20+/m0/s1

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InChIKey

KNDQTTHAEJUPJU-HZTCUHRNSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

KNDQTTHAEJUPJU-HZTCUHRNSA-N

(Q105143352)

(1R,9R,10S,12R,13E,16S,17S,18S)-13-ethylidene-8-methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2(7),3,5-triene-6,18-diol

Statements

Identifiers

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