Diarylheptanoids

(3S,5S,E)-1,7-Diphenylhept-1-ene-3,5-diol

(1E,3S,5S)-1,7-二苯基-1-庚烯-3,5-二醇

PHY-NP-02148 · Natural product research catalog

Catalog number	PHY-NP-02148
CAS number	87095-75-8
Molecular formula	C₁₉H₂₂O₂
Molecular weight	282.383 g/mol
Chemical class	Diarylheptanoids
Main reported source	Alpinia hainanensis
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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Product information

(3S,5S,E)-1,7-Diphenylhept-1-ene-3,5-diol is listed in the Diarylheptanoids 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	(E,3S,5S)-1,7-diphenylhept-1-ene-3,5-diol
SMILES	C1=CC=C(C=C1)CC[C@@H](C[C@@H](/C=C/C2=CC=CC=C2)O)O
InChIKey	YSRHCYXKOMRFPK-SHVSIGCLSA-N
Subclass / scaffold	二芳基庚烷
PubChem CID	45483934

Computed properties

Exact mass (Da)	282.162	Predicted LogP	3.4445
Predicted TPSA (Å²)	40.46	H-bond donors	2
H-bond acceptors	2	Rotatable bonds	7

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

View additional properties & classification

Ring count	2
Aromatic rings	2
Fraction Csp³	0.263
Synthetic accessibility score	2.68
QED score	0.816
Lipinski rule violations	0
NPClassifier pathway	Shikimates and Phenylpropanoids
NPClassifier superclass	Phenylpropanoids (C6-C3)
Parent SMILES	O[C@@H](CCc1ccccc1)C[C@H](O)/C=C/c1ccccc1
Parent formula	C₁₉H₂₂O₂
Parent molecular weight	282.383
Specified stereocenters	2
Unspecified stereocenters	0

Reported natural occurrence

Main reported source	Alpinia hainanensis
Reported source families	Zingiberaceae

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

View occurrence records & references

LOTUS / Wikidata species	Alpinia hainanensis[2]; Alpinia katsumadai[2]; Alpinia pinnanensis[1]
All reported source families	Zingiberaceae[3]
LOTUS species records	3
LOTUS reference records	3
COCONUT occurrence records	Alpinia hainanensis; Alpinia katsumadai; Alpinia pinnanensis
COCONUT organism records	3
COCONUT identifier	CNP0151997.1

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 / solubility	Product-specific conditions to be confirmed
Shipping	Confirmed with the quotation

Request applicable documentation and handling information before ordering or use.