Flavonoids

Macarangin

血桐素

PHY-NP-17888 · Natural product research catalog

Catalog number	PHY-NP-17888
CAS number	129385-65-5
Molecular formula	C₂₅H₂₆O₆
Molecular weight	422.477 g/mol
Chemical class	Flavonoids
Main reported source	Macaranga vedeliana
Purity / assay	Min. 98% Other purity specifications available on inquiry.

Chemical structure

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Macarangin 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.

IUPAC name	6-[(2E)-3,7-dimethylocta-2,6-dienyl]-3,5,7-trihydroxy-2-(4-hydroxyphenyl)chromen-4-one
SMILES	CC(=CCC/C(=C/CC1=C(C2=C(C=C1O)OC(=C(C2=O)O)C3=CC=C(C=C3)O)O)/C)C
InChIKey	MBIJQAHZUBUPNM-VIZOYTHASA-N
Subclass / scaffold	Flavonols
PubChem CID	10047854

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

View additional properties & classification

Ring count	3
Aromatic rings	3
Fraction Csp³	0.24
Synthetic accessibility score	2.95
QED score	0.389
Lipinski rule violations	1
NPClassifier pathway	Shikimates and Phenylpropanoids
NPClassifier superclass	Flavonoids
NPClassifier class	Flavonols
Parent SMILES	CC(C)=CCC/C(C)=C/Cc1c(O)cc2oc(-c3ccc(O)cc3)c(O)c(=O)c2c1O
Parent formula	C₂₅H₂₆O₆
Parent molecular weight	422.477
Specified stereocenters	0
Unspecified stereocenters	0

Main reported source	Macaranga vedeliana
Reported source families	Euphorbiaceae; Dipterocarpaceae

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

View occurrence records & references

LOTUS / Wikidata species	Macaranga vedeliana[2]; Macaranga denticulata[1]; Monotes africana[1]; Monotes africanus[1]
All reported source families	Euphorbiaceae[2]; Dipterocarpaceae[2]
LOTUS species records	4
LOTUS reference records	4
COCONUT occurrence records	Apis mellifera ligustica; Apis species; Macaranga bicolor; Macaranga denticulata; Macaranga vedeliana; Monotes africana; Monotes africanus; monotes africanus
COCONUT organism records	8
COCONUT identifier	CNP0348272.1

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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