Diterpenoids

Alepterolic acid

PHY-NP-02922 · Natural product research catalog

Catalog number	PHY-NP-02922
CAS number	63399-38-2
Molecular formula	C₂₀H₃₂O₃
Molecular weight	320.473 g/mol
Chemical class	Diterpenoids
Main reported source	Copaifera
Purity / assay	Min. 98% Other purity specifications available on inquiry.

Chemical structure

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Pack	Price (USD)	Availability	Lead time
5 mg	Request quote	To be confirmed	Confirm in quotation
10 mg	Request quote	To be confirmed	Confirm in quotation
20 mg	Request quote	To be confirmed	Confirm in quotation
50 mg	Request quote	To be confirmed	Confirm in quotation
100 mg	Request quote	To be confirmed	Confirm in quotation

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Alepterolic acid is listed in the Diterpenoids 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	(E)-5-[(1S,4aR,6S,8aR)-6-hydroxy-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-2-enoic acid
SMILES	CC(=CC(=O)O)CC[C@H]1C(=C)CC[C@@H]2[C@@]1(CC[C@@H](C2(C)C)O)C
InChIKey	LNWOKEZJIRLIDO-OGNFBWPZSA-N
Subclass / scaffold	Labdane diterpenoids Norlabdane diterpenoids
PubChem CID	13858188

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

View additional properties & classification

Ring count	2
Aromatic rings	0
Fraction Csp³	0.75
Synthetic accessibility score	4.05
QED score	0.589
Lipinski rule violations	0
NPClassifier pathway	Terpenoids
NPClassifier superclass	Diterpenoids
NPClassifier class	Labdane diterpenoids；Norlabdane diterpenoids
Parent SMILES	C=C1CC[C@H]2C(C)(C)[C@@H](O)CC[C@]2(C)[C@H]1CCC(C)=CC(=O)O
Parent formula	C₂₀H₃₂O₃
Parent molecular weight	320.473
Specified stereocenters	4
Unspecified stereocenters	0

Main reported source	Copaifera

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

View occurrence records & references

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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