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Triterpenoids

Eurycomanol 2-O-|A-D-glucopyranoside

东革阿里-2-O-β-D-葡萄糖苷

PHY-NP-01447 · Natural product research catalog

Catalog numberPHY-NP-01447
CAS number126260-97-7
Molecular formulaC26H36O14
Molecular weight572.56 g/mol
Chemical classTriterpenoids
Main reported sourceEurycoma longifolia
Purity / assayMin. 98%
Other purity specifications available on inquiry.

Chemical structure

Chemical structure of Eurycomanol 2-O-|A-D-glucopyranoside

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Product information

Eurycomanol 2-O-|A-D-glucopyranoside is listed in the Triterpenoids 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.

Names & identifiers

IUPAC name(1R,4R,5R,7R,8R,11R,13S,16S,17S,18S,19R)-4,5,7,8,17-pentahydroxy-14,18-dimethyl-6-methylidene-16-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,10-dioxapentacyclo[9.8.0.01,7.04,19.013,18]nonadec-14-en-9-one
SMILESCC1=C[C@@H]([C@H]([C@]2([C@H]1C[C@@H]3[C@]45[C@@H]2[C@]([C@@H](C(=C)[C@@]4([C@H](C(=O)O3)O)O)O)(OC5)O)C)O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O
InChIKeyXWUBEYICEUBFTO-ATAJOHBKSA-N
Subclass / scaffoldQuassinoids;皂苷/苷
PubChem CID101637225

Computed properties

Exact mass (Da)572.2105Predicted LogP-4.212
Predicted TPSA (Ų)236.06H-bond donors9
H-bond acceptors14Rotatable bonds3

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

View additional properties & classification
Ring count6
Aromatic rings0
Fraction Csp³0.808
Synthetic accessibility score7.14
QED score0.115
Lipinski rule violations3
NPClassifier pathwayTerpenoids
NPClassifier superclassTriterpenoids
NPClassifier classQuassinoids
Parent SMILESC=C1[C@@H](O)[C@]2(O)OC[C@]34[C@H]2[C@@]2(C)[C@H](O)[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)C=C(C)[C@@H]2C[C@H]3OC(=O)[C@H](O)[C@@]14O
Parent formulaC26H36O14
Parent molecular weight572.56
Specified stereocenters16
Unspecified stereocenters0

Reported natural occurrence

Main reported sourceEurycoma longifolia
Reported source familiesSimaroubaceae

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

View occurrence records & references
LOTUS / Wikidata speciesEurycoma longifolia[4]
All reported source familiesSimaroubaceae[1]
LOTUS species records1
LOTUS reference records4
COCONUT occurrence recordsAcinetobacter baumannii; Acinetobacter calcoaceticus; Aralidium pinnatifidum; Bersama swinnyi; Blainvillea latifolia; Boletinus paluster; Cheilanthes marantae; Dermocybe cardinalis; Euphorbia resinifera; Eurycoma longifolia; Geigeria schinzii; Goniothalamus undulatus; Helichrysum angustifolium; Helichrysum sutherlandii; Heterosigma akashiwo; Leontice kiangnanensis; Lophiostoma vaginatispora; Lophocereus marginatus; Medium grandiflorum; Monanchora unguiculata; Nemuaron humboldtii; Ophryosporus charua; Pachycereus pringlei; Papaver radicatum; Penicillium alutaceum; Pinus glauca; Prosopis kuntzei; Pteris spinulosa; Russula sardonia; Stenocereus thurberi
COCONUT organism records31
COCONUT identifierCNP0175466.1

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

Documents & specifications

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

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