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glabrone

glabrone

CAS: 60008-02-8

Formula: C20H16O5

SMILES: CC1(C)OC2=CC=C(C(O)=C2C=C1)C1=COC2=CC(O)=CC=C2C1=O

IUPAC: 5',7-dihydroxy-2',2'-dimethyl-2'H,4H-[3,6'-bichromen]-4-one

InChI: InChI=1S/C20H16O5/c1-20(2)8-7-14-16(25-20)6-5-12(18(14)22)15-10-24-17-9-11(21)3-4-13(17)19(15)23/h3-10,21-22H,1-2H3

Composition: C (71.42%), H (4.80%), O (23.78%)

Molar Mass: 336.343

Atom Count: 41

Heavy Atom Count: 25

Properties
Properties
Common Names glabrone
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 336.099773615
Formal Charge 0
FSP3 0.15
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 2
InChIKey COLMVFWKLOZOOP-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 94.1
Topological Polar Surface Area 75.99
Polarizability 35.32
Ring Count 4
Rotatable Bond Count 1

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Purity LeadTime CAS PacketSize UnitPrice
98% <5 Days 60008-02-8 $683.00$683.00
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