Alkaloids

(+)-Ajmaline

萝芙木碱

PHY-NP-09653 · Natural product research catalog

Catalog number	PHY-NP-09653
CAS number	4360-12-7
Molecular formula	C₂₀H₂₆N₂O₂
Molecular weight	326.44 g/mol
Chemical class	Alkaloids
Main reported source	Rauvolfia serpentina
Purity / assay	Min. 98% Other purity specifications available on inquiry.

Chemical structure

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(+)-Ajmaline is listed in the Alkaloids section of the Phytide Bio research catalog. Standard pack sizes are 5, 10, 20, 50 and 100 mg.

For research use only. Not for human or veterinary use, diagnosis or treatment.

IUPAC name	(1R,9R,10S,12R,13S,14R,16S,17S,18R)-13-ethyl-8-methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-triene-14,18-diol
SMILES	CC[C@H]1[C@@H]2C[C@H]3[C@H]4[C@@]5(C[C@@H]([C@H]2[C@H]5O)N3[C@@H]1O)C6=CC=CC=C6N4C
InChIKey	CJDRUOGAGYHKKD-RQBLFBSQSA-N
Subclass / scaffold	Tryptophan alkaloids：Corynanthe type
PubChem CID	6100671

Calculated values from the supplied dataset; not measured batch specifications.

View additional properties & classification

Ring count	7
Aromatic rings	1
Fraction Csp³	0.7
Synthetic accessibility score	6.38
QED score	0.822
Lipinski rule violations	0
NPClassifier pathway	Alkaloids
NPClassifier superclass	Tryptophan alkaloids
NPClassifier class	Corynanthe type
Parent SMILES	CC[C@H]1[C@@H]2C[C@H]3[C@@H]4N(C)c5ccccc5[C@]45C[C@@H]([C@H]2[C@H]5O)N3[C@@H]1O
Parent formula	C₂₀H₂₆N₂O₂
Parent molecular weight	326.44
Specified stereocenters	9
Unspecified stereocenters	1

Main reported source	Rauvolfia serpentina
Reported source families	Apocynaceae; Verbenaceae

Reported natural occurrence does not establish the manufacturing origin of the supplied material.

View occurrence records & references

LOTUS / Wikidata species	Rauvolfia serpentina[23]; Rauvolfia afra[3]; Rauvolfia verticillata[3]; Rauvolfia volkensii[3]; Melodinus balansae[2]; Rauvolfia yunnanensis[2]; Citharexylum flexuosum[1]; Melodinus guillauminii[1]; Rauvolfia balansae[1]; Rauvolfia biauriculata[1]; Rauvolfia cambodiana[1]; Rauvolfia cubana[1]; Rauvolfia mombasiana[1]; Rauvolfia spathulata[1]; Rauvolfia tetraphylla[1]
All reported source families	Apocynaceae[17]; Verbenaceae[1]
Genus / family records	Rauvolfia[1]
LOTUS species records	17
LOTUS reference records	39
COCONUT occurrence records	Citharexylum flexuosum; Melodinus balansae; Melodinus guillauminii; Rauvolfia; Rauvolfia Cambodiana; Rauvolfia Serpentina; Rauvolfia Tetraphylla; Rauvolfia Verticillata; Rauvolfia Vomitoria; Rauvolfia Yunnanensis; Rauvolfia afra; Rauvolfia balansae; Rauvolfia biauriculata; Rauvolfia cambodiana; Rauvolfia cubana; Rauvolfia mombasiana; Rauvolfia serpentina; Rauvolfia spathulata; Rauvolfia tetraphylla; Rauvolfia verticillata; Rauvolfia viridis; Rauvolfia volkensii; Rauvolfia vomitoria; Rauvolfia yunnanensis
COCONUT organism records	24
COCONUT identifier	CNP0243746.5

Records are inherited from the supplied dataset and are not independently verified. Taxonomic names may include synonyms.

Certificate of analysis (COA)	Batch-specific COA available on request; no PDF published yet
Safety data sheet (SDS)	Not yet published
Storage / solubility	Product-specific conditions to be confirmed
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