(Q83112450)

English

Iboxygaine

group of stereoisomers with the chemical formula C₂₀H₂₆N₂O₂

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Statements

instance of

group of stereoisomers

0 references

subclass of

iboga alkaloid

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mass

326.19942807199993 dalton

1 reference

based on heuristic

inferred from isomeric SMILES

chemical formula

C₂₀H₂₆N₂O₂

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canonical SMILES

OC(C)C1CC2CN3CCC=4C=5C=C(OC)C=CC5NC4C(C2)C31

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isomeric SMILES

COc1ccc2[nH]c3c(c2c1)CCN1C[C@H]2C[C@@H]3[C@@H]1[C@H]([C@H](C)O)C2

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found in taxon

Tabernanthe iboga

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stated in

Alcaloides de Tabernanthe pubescens

Tabernaemontana catharinensis

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stated in

Alcalóides de Peschiera affinis (Muell. Arg) Miers (Apocynaceae)

Tabernaemontana corymbosa

1 reference

stated in

Alkaloids from leaves and root bark ofErvatamia hirta

Tabernaemontana orientalis

1 reference

stated in

Tabernaemontana L. (Apocynaceae): A review of its taxonomy, phytochemistry, ethnobotany and pharmacology

Tabernaemontana lundii

1 reference

stated in

Tabernaemontana L. (Apocynaceae): A review of its taxonomy, phytochemistry, ethnobotany and pharmacology

Tabernaemontana humblotii

1 reference

stated in

Tabernaemontana L. (Apocynaceae): A review of its taxonomy, phytochemistry, ethnobotany and pharmacology

Tabernaemontana pandacaqui

1 reference

stated in

Tabernaemontana L. (Apocynaceae): A review of its taxonomy, phytochemistry, ethnobotany and pharmacology

Tabernaemontana hystrix

1 reference

stated in

Tabernaemontana L. (Apocynaceae): A review of its taxonomy, phytochemistry, ethnobotany and pharmacology

Identifiers

InChI

InChI=1S/C20H26N2O2/c1-11(23)15-7-12-8-17-19-14(5-6-22(10-12)20(15)17)16-9-13(24-2)3-4-18(16)21-19/h3-4,9,11-12,15,17,20-21,23H,5-8,10H2,1-2H3/t11-,12+,15-,17-,20-/m0/s1

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InChIKey

QLSITYRYHBQHBY-BFRPBLBHSA-N

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CAS Registry Number

82-55-3

1 reference

InChIKey

QLSITYRYHBQHBY-BFRPBLBHSA-N

8 April 2021

https://commonchemistry.cas.org/detail?cas_rn=82-55-3

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

QLSITYRYHBQHBY-BFRPBLBHSA-N

1 reference

1 reference

matched by identifier from

InChIKey

QLSITYRYHBQHBY-BFRPBLBHSA-N

DSSTOX compound identifier

DTXCID50153999

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(Q83112450)

Iboxygaine

Statements

Identifiers

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