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Triterpenoids

Karaviloside X

斯里兰卡苦瓜苷X

PHY-NP-00143 · Natural product research catalog

Catalog numberPHY-NP-00143
CAS number934739-34-1
Molecular formulaC42H68O14
Molecular weight796.992 g/mol
Chemical classTriterpenoids
Main reported sourceMomordica charantia
Purity / assayMin. 98%
Other purity specifications available on inquiry.

Chemical structure

Chemical structure of Karaviloside X

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Product information

Karaviloside X 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(2R,3S,4R,5R,6R)-2-(hydroxymethyl)-6-[[(1R,4S,5S,8R,9R,12S,13S,16S)-8-[(2S)-3-hydroxy-6-methyl-4-[(2R,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhept-5-en-2-yl]-5,9,17,17-tetramethyl-18-oxapentacyclo[10.5.2.01,13.04,12.05,9]nonadec-2-en-16-yl]oxy]oxane-3,4,5-triol
SMILESC[C@@H]([C@H]1CC[C@@]2([C@@]1(CC[C@]34[C@H]2C=C[C@]5([C@H]3CC[C@@H](C5(C)C)O[C@H]6[C@@H]([C@@H]([C@@H]([C@H](O6)CO)O)O)O)OC4)C)C)C(C(C=C(C)C)O[C@H]7[C@@H]([C@@H]([C@@H]([C@H](O7)CO)O)O)O)O
InChIKeyUVPDCWZQGLOBOB-WZLYLOCQSA-N
Subclass / scaffoldCucurbitane triterpenoids;皂苷/苷
PubChem CID102155367

Computed properties

Exact mass (Da)796.4609Predicted LogP0.9138
Predicted TPSA (Ų)228.22H-bond donors9
H-bond acceptors14Rotatable bonds10

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

View additional properties & classification
Ring count7
Aromatic rings0
Fraction Csp³0.905
Synthetic accessibility score7.44
QED score0.14
Lipinski rule violations3
NPClassifier pathwayTerpenoids
NPClassifier superclassTriterpenoids
NPClassifier classCucurbitane triterpenoids
Parent SMILESCC(C)=CC(O[C@@H]1O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)C(O)[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H]3C=C[C@@]45OC[C@]3(CC[C@]12C)[C@@H]4CC[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)C5(C)C
Parent formulaC42H68O14
Parent molecular weight796.992
Specified stereocenters19
Unspecified stereocenters2

Reported natural occurrence

Main reported sourceMomordica charantia

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

View occurrence records & references
LOTUS species records0
LOTUS reference records0
COCONUT occurrence recordsMomordica charantia
COCONUT organism records1
COCONUT identifierCNP0169303.2

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

Request applicable documentation and handling information before ordering or use.