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Chemical structure of Demethylsuberosin

GC38152

Demethylsuberosin

Also known as 7-hydroxy-6-(3-methylbut-2-enyl)chromen-2-one

Demethylsuberosin (7-Demethylsuberosin) is a coumarin compound isolated from Angelica gigas Nakai, and has anti-inflammatory activity

ChemicalCAS21422-04-8MW230.26FormulaC14H14O3
CAS number
21422-04-8
Molecular weight
230.26
Formula
C14H14O3
Solubility
DMSO: 250 mg/mL (1085·73 mM)
InChIKey
FIDUIAPDSKSUGO-UHFFFAOYSA-N
Catalogue number
GC38152
Brand
GLPBIO
Computed properties PubChem CID 5316525 · XLogP 3.5 · TPSA 46.5 Ų · H-bond donors 1
XLogP
3.5
TPSA
46.5 Ų
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
17

SMILES CC(=CCC1=C(C=C2C(=C1)C=CC(=O)O2)O)C

Computed descriptors from PubChem (CID 5316525), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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