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(Q105280451)
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English
methyl (15R,18S,19R,20R)-18-hydroxy-14,15,16,17,18,19,20,21-octahydroyohimban-19-carboxylate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
methyl 18-hydroxy-3,13-diazapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]henicosa-1,3,5,7,9,11-hexaene-19-carboxylate
1 reference
based on heuristic
inferred from SMILES
mass
350.163042564
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
3,4,5,6-Tetradehydroyohimbine
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₁H₂₂N₂O₃
0 references
canonical SMILES
O=C(OC)C1C(O)CCC2CN3C=CC=4C(N=C5C=CC=CC54)=C3CC12
0 references
isomeric SMILES
COC(=O)[C@H]1[C@@H](O)CC[C@H]2Cn3ccc4c5ccccc5nc-4c3C[C@H]21
0 references
found in taxon
Rauvolfia serpentina
1 reference
stated in
Anhydronium bases from Rauvolfia serpentina
Catharanthus roseus
1 reference
stated in
Identification, characterization and distribution of terpene indole alkaloids in ethanolic extracts of Catharanthus roseus using high-performance liquid chromatography/electrospray ionization quadrupole time-of-flight tandem mass spectrometry and th
Identifiers
InChI
InChI=1S/C21H22N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,8-9,12,15,18-19,24H,6-7,10-11H2,1H3/t12-,15+,18-,19+/m0/s1
0 references
InChIKey
UWMTZXSCMQAECK-PQDLGVTNSA-N
0 references
PubChem CID
163185895
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
UWMTZXSCMQAECK-PQDLGVTNSA-N
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