Triterpenoids

Kizuta saponin K11

菱叶常春藤皂苷K11

PHY-NP-01256 · Natural product research catalog

Catalog number	PHY-NP-01256
CAS number	97240-03-4
Molecular formula	C₆₁H₉₈O₂₇
Molecular weight	1263.428 g/mol
Chemical class	Triterpenoids
Main reported source	Hedera nepalensis
Purity / assay	Min. 98% Other purity specifications available on inquiry.

Chemical structure

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Kizuta saponin K11 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.

IUPAC name	[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-6-(acetyloxymethyl)-3,4-dihydroxy-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
SMILES	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2O)O)OC[C@@H]3[C@H]([C@@H]([C@H]([C@@H](O3)OC(=O)[C@@]45CC[C@@]6(C(=CC[C@H]7[C@]6(CC[C@@H]8[C@@]7(CC[C@@H]([C@@]8(C)CO)O[C@H]9[C@@H]([C@H]([C@H](CO9)O)O)O[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O)C)C)[C@@H]4CC(CC5)(C)C)C)O)O)O)COC(=O)C)O)O)O
InChIKey	YYMHTAGTVKFQOP-KZYQMVRLSA-N
Subclass / scaffold	Oleanane triterpenoids；皂苷/苷
PubChem CID	21636378

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

View additional properties & classification

Ring count	10
Aromatic rings	0
Fraction Csp³	0.934
Synthetic accessibility score	7.34
QED score	0.051
Lipinski rule violations	3
NPClassifier pathway	Terpenoids
NPClassifier superclass	Triterpenoids
NPClassifier class	Oleanane triterpenoids
Parent SMILES	CC(=O)OC[C@H]1O[C@@H](OC[C@H]2O[C@@H](OC(=O)[C@]34CCC(C)(C)C[C@H]3C3=CC[C@@H]5[C@@]6(C)CC[C@H](O[C@@H]7OC[C@H](O)[C@H](O)[C@H]7O[C@@H]7O[C@@H](C)[C@H](O)[C@@H](O)[C@H]7O)[C@@](C)(CO)[C@@H]6CC[C@@]5(C)[C@]3(C)CC4)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O
Parent formula	C₆₁H₉₈O₂₇
Parent molecular weight	1263.428
Specified stereocenters	33
Unspecified stereocenters	0

Main reported source	Hedera nepalensis
Reported source families	Araliaceae

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

View occurrence records & references

LOTUS / Wikidata species	Hedera nepalensis[1]; Hedera rhombea[1]; Oreopanax guatemalensis[1]
All reported source families	Araliaceae[3]
LOTUS species records	3
LOTUS reference records	3
COCONUT occurrence records	Alkanna tinctoria; Bathynella natans; Centaurea hermannii; Eunicea laciniata; Hedera nepalensis; Hedera rhombea; Oreopanax guatemalensis; Phanera vahlii; Resseliella theobaldi; Seseli elatum; Streptomyces clavuligerus; Strychnos hirsuta; Thalictrum rugosum
COCONUT organism records	13
COCONUT identifier	CNP0246176.1

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
Shipping	Confirmed with the quotation

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