AC1L36PW structure

AC1L36PW

(4-hydroxy-11-methoxy-16,18-dioxo-6,8,19-trioxapentacyclo[10.7.0.02,9.03,7.013,17]nonadeca-1,9,11,13(17)-tetraen-5-yl) acetate

Also Known As: 8-Acetoxy-9-hydroxy-8,9-dihydro-aflatoxin B1|9-hydroxy-4-methoxy-1,11-dioxo-1,2,3,6a,8,9,9a,11-octahydrocyclopenta[c]furo[3',2':4,5]furo[2,3-h]chromen-8-yl acetate|4-hydroxy-11-methoxy-16,18-dioxo-6,8,19-trioxapentacyclo[10.7.0.02,9.03,7.013,17]nonadeca-1,9,11,13(17)-tetraen-5-yl acetate|8-Acetoxy-2,3,6a,8,9,9a-hexahydro-9-hydroxy-4-methoxycyclopenta[c]furo[3 ,2 :4,5]furo[2,3-h][1]benzopyran-1,11-dione|8-Acetoxy-2,3,6a,8,9,9a-hexahydro-9-hydroxy-4-methoxycyclopenta[c]furo[3',2':4,5]furo[2,3-h][1]benzopyran-1,11-dione|9-Hydroxy-4-methoxy-1,11-dioxo-1,2,3,6a,8,9,9a,11-octahydrocyclopenta[c]furo[3',2':4,5]furo[2,3-h][1]benzopyran-8-yl acetate|Cyclopenta(c)furo(3',2':4,5)furo(2,3-h)(1)benzopyran-1,11-dione, 2,3,6a,8,9,9a-hexahydro-8,9-dihydroxy-4-methoxy-, 8-acetate

CAS: 78-91-1
Molecular Formula C19H16O9
Molecular Weight 388.07944 g/mol
LogP 0.4
Topological Polar Surface Area 118.0 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 9
Rotatable Bonds 3
Exact Mass 388.07944
Monoisotopic Mass 388.07944
Heavy Atoms 28
Complexity 773.0

Chemical Identifiers

CAS Number 78-91-1
SMILES CC(=O)OC1C(C2C(O1)OC3=CC(=C4C5=C(C(=O)CC5)C(=O)OC4=C23)OC)O
InChIKey CLZUAYVLLCXDCD-UHFFFAOYSA-N

Product Overview

AC1L36PW (CAS 78-91-1), with molecular formula C19H16O9 and molecular weight 388.07944 g/mol. IUPAC: (4-hydroxy-11-methoxy-16,18-dioxo-6,8,19-trioxapentacyclo[10.7.0.02,9.03,7.013,17]nonadeca-1,9,11,13(17)-tetraen-5-yl) acetate.

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