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AA-504/20833001 is available in 1687 mg

Compound details
Formula:		C11 H6 O3
Weight:		186.17
Chiral info:		Not available
Name:		Angelicin (Isopsoralen)
SMILES:		O=C2C=Cc3ccc1occc1c3(O2)
InChI^TM:		InChI=1S/C11H6O3/c12-10-4-2-7-1-3-9-8(5-6-13-9)11(7)14-10/h1-6H
InChIKey^TM:		XDROKJSWHURZGO-UHFFFAOYSA-N

Chemical properties calculations
LogP:	2.08	H-acceptors: 1
LogS:	-2.34
tPSA:	39.44 Å²	Rotatable bonds: 0

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