Triterpenoids

Dipterocarpol

龙脑香醇酮

PHY-NP-00297 · Natural product research catalog

Catalog number	PHY-NP-00297
CAS number	471-69-2
Molecular formula	C₃₀H₅₀O₂
Molecular weight	442.728 g/mol
Chemical class	Triterpenoids
Main reported source	Betula platyphylla var. japonica
Purity / assay	Min. 98% Other purity specifications available on inquiry.

Chemical structure

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Dipterocarpol 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	(5R,8R,9R,10R,13R,14R,17S)-17-[(2S)-2-hydroxy-6-methylhept-5-en-2-yl]-4,4,8,10,14-pentamethyl-1,2,5,6,7,9,11,12,13,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
SMILES	CC(=CCC[C@@](C)([C@H]1CC[C@@]2([C@@H]1CC[C@H]3[C@]2(CC[C@@H]4[C@@]3(CCC(=O)C4(C)C)C)C)C)O)C
InChIKey	NJICGAVMYWKCMW-GWJXCKMPSA-N
Subclass / scaffold	Dammarane and Protostane triterpenoids
PubChem CID	441676

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

View additional properties & classification

Ring count	4
Aromatic rings	0
Fraction Csp³	0.9
Synthetic accessibility score	4.65
QED score	0.452
Lipinski rule violations	1
NPClassifier pathway	Terpenoids
NPClassifier superclass	Triterpenoids
NPClassifier class	Dammarane and Protostane triterpenoids
Parent SMILES	CC(C)=CCC[C@](C)(O)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@H]1[C@@]3(C)CCC(=O)C(C)(C)[C@@H]3CC[C@]12C
Parent formula	C₃₀H₅₀O₂
Parent molecular weight	442.728
Specified stereocenters	8
Unspecified stereocenters	0

Main reported source	Betula platyphylla var. japonica
Reported source families	Betulaceae; Simaroubaceae; Meliaceae

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

View occurrence records & references

LOTUS / Wikidata species	Betula platyphylla var. japonica[1]; Brucea javanica[1]; Dysoxylum malabaricum[1]
All reported source families	Betulaceae[1]; Simaroubaceae[1]; Meliaceae[1]
LOTUS species records	3
LOTUS reference records	3
COCONUT occurrence records	Ailanthus altissima; Amoora rohituka; Andropogon laniger; Baccharis minutiflora; Baccharis sarothroides; Betula platyphylla var. japonica; Brucea javanica; Capparis flavicans; Dipterocarpus acutangulus; Dysoxylum malabaricum; Halimium halimifolium; Heliotropium olgae; Ipomoea hederacea; Lasioderma serricorne; Malus sieboldii; Micranthes stellaris; Oxytropis pseudoglandulosa; Pedicularis plicata; Peltigera venosa; Pistacia terebinthus; Rabdosia flexicaulis; Scaphechinus mirabilis; Sideritis flavovirens; Sonchus gummifer; Stephania hispidula; Streptomyces halstedii; Tragopogon orientalis; Umbilicaria spodochroa; Vaccaria hispanica; Xylosalsola richteri
COCONUT organism records	31
COCONUT identifier	CNP0192520.4

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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