(Q82989718)

English

Methyl 13-hydroxyibogamine-18-carboxylate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

11-Hydroxycoronaridine

1 reference

based on heuristic

inferred from SMILES

methyl 17-ethyl-6-hydroxy-3,13-diazapentacyclo[13.3.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]nonadeca-2(10),4,6,8-tetraene-1-carboxylate

1 reference

based on heuristic

inferred from SMILES

mass

354.194342692 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₁H₂₆N₂O₃

0 references

canonical SMILES

O=C(OC)C12C=3NC=4C=C(O)C=CC4C3CCN5CC(CC(CC)C51)C2

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isomeric SMILES

CC[C@H]1C[C@H]2CN3CCc4c([nH]c5cc(O)ccc45)[C@](C(=O)OC)(C2)[C@H]13

0 references

found in taxon

Tabernaemontana calcarea

2 references

stated in

New Cytotoxic Indole Alkaloids from Tabernaemontana calcarea from the Madagascar Rainforest

stated in

New Cytotoxic Indole Alkaloids fromTabernaemontana calcareafrom the Madagascar Rainforest.

Tabernaemontana eglandulosa

1 reference

stated in

Alkaloids of Tabernaemontana eglandulosa

Identifiers

InChI

InChI=1S/C21H26N2O3/c1-3-13-8-12-10-21(20(25)26-2)18-16(6-7-23(11-12)19(13)21)15-5-4-14(24)9-17(15)22-18/h4-5,9,12-13,19,22,24H,3,6-8,10-11H2,1-2H3/t12-,13+,19+,21-/m1/s1

0 references

InChIKey

GFEUNVMURRUASI-YDBSYXHISA-N

0 references

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

GFEUNVMURRUASI-YDBSYXHISA-N

1 reference

1 reference

matched by identifier from

InChIKey

GFEUNVMURRUASI-YDBSYXHISA-N

DSSTOX compound identifier

DTXCID301424551

0 references

(Q82989718)

Methyl 13-hydroxyibogamine-18-carboxylate

Statements

Identifiers

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