Flavonoids

2H-1-Benzopyran-7-ol, 3,4-dihydro-2-(4-hydroxyphenyl)-, (2S)-

腊肠树黄烷

PHY-NP-17061 · Natural product research catalog

Catalog number	PHY-NP-17061
CAS number	82925-54-0
Molecular formula	C₁₅H₁₄O₃
Molecular weight	242.274 g/mol
Chemical class	Flavonoids
Main reported source	Botrytis cinerea
Purity / assay	Min. 98% Other purity specifications available on inquiry.

Chemical structure

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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

2H-1-Benzopyran-7-ol, 3,4-dihydro-2-(4-hydroxyphenyl)-, (2S)- is listed in the Flavonoids 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	(2S)-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-7-ol
SMILES	C1CC2=C(C=C(C=C2)O)O[C@@H]1C3=CC=C(C=C3)O
InChIKey	YXMLGIGHGPSEKA-AWEZNQCLSA-N
Subclass / scaffold	Flavans
PubChem CID	158280

Computed properties

Exact mass (Da)	242.0943	Predicted LogP	3.1641
Predicted TPSA (Å²)	49.69	H-bond donors	2
H-bond acceptors	3	Rotatable bonds	1

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

View additional properties & classification

Ring count	3
Aromatic rings	2
Fraction Csp³	0.2
Synthetic accessibility score	2.62
QED score	0.807
Lipinski rule violations	0
NPClassifier pathway	Shikimates and Phenylpropanoids
NPClassifier superclass	Flavonoids
NPClassifier class	Flavans
Parent SMILES	Oc1ccc([C@@H]2CCc3ccc(O)cc3O2)cc1
Parent formula	C₁₅H₁₄O₃
Parent molecular weight	242.274
Specified stereocenters	1
Unspecified stereocenters	0

Reported natural occurrence

Main reported source	Botrytis cinerea
Reported source families	Moraceae; Sclerotiniaceae; Solanaceae

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

View occurrence records & references

LOTUS / Wikidata species	Botrytis cinerea[1]; Brosimum acutifolium[1]; Broussonetia kazinoki × B. papyrifera[1]; Broussonetia papyrifera[1]; Dracaena draco[1]; Garcinia dulcis[1]; Habranthus brachyandrus[1]; Schnella guianensis[1]; Soymida febrifuga[1]
All reported source families	Moraceae[3]; Sclerotiniaceae[1]; Solanaceae[1]; Clusiaceae[1]; Amaryllidaceae[1]; Fabaceae[1]
LOTUS species records	9
LOTUS reference records	9
COCONUT occurrence records	Bauhinia manca; Botrytis cinerea; Brosimum acutifolium; Broussonetia Kazinoki; Broussonetia Papyrifera; Broussonetia kazinoki; Broussonetia kazinoki × B. papyrifera; Broussonetia papyrifera; Dalbergia latifolia; Dracaena draco; Garcinia dulcis; Habranthus brachyandrus; Narcissus pseudonarcissus; Schnella guianensis; Soymida febrifuga
COCONUT organism records	15
COCONUT identifier	CNP0105252.1

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.