Pterocarpin structure

Pterocarpin

(1R,12R)-16-methoxy-5,7,11,19-tetraoxapentacyclo[10.8.0.02,10.04,8.013,18]icosa-2,4(8),9,13(18),14,16-hexaene

Also Known As: Pterocarpin|Pterocarpine|(-)-Pterocarpin|3-Methoxy maackiain|(-)-cis-Pterocarpin|Pterocarpin [MI]|Pterocarpin, (-)-|3-Methoxymaackiain|Pterocarpin methylether|Maackiain, methyl ether|YLZYAUCOYZKLMA-SJCJKPOMSA-|3-Methoxy-8,9-methylenedioxypterocarpan|NCGC00160175-01|(6aR,12aR)-6a,12a-Dihydro-3-methoxy-6H-(1,3)dioxolo(5,6)benzofuro(3,2-C)(1)benzopyran|AC-776/21258025|AN-566/21182004|6H-(1,3)Dioxolo(5,6)benzofuro(3,2-C)(1)benzopyran, 6a,12a-dihydro-3-methoxy-, (6aR,12aR)-|(1R,12R)-16-methoxy-5,7,11,19-tetraoxapentacyclo[10.8.0.02,10.04,8.013,18]icosa-2,4(8),9,13(18),14,16-hexaene|(6aR,12aR)-6a,12a-Dihydro-3-methoxy-6H-[1,3]dioxolo[5 ,6]benzofuro[3,2-c][1]benzopyran|(6aR-cis)-6a,12a-Dihydro-3-methoxy-6H-[1,3]dioxolo[5,6]benzofuro[3,2-c][1]benzopyran|3-Methoxy-6a,12a-dihydro-6H-[1,3]dioxolo[4',5':5,6][1]benzofuro[3,2-c]chromene #|(1R,12R)-16-methoxy-5,7,11,19-tetraoxapentacyclo(10.8.0.02,10.04,8.013,18)icosa-2,4(8),9,13(18),14,16-hexaene|(1R,12R)-16-methoxy-5,7,11,19-tetraoxapentacyclo[10.8.0.02,10.04,8.013,18]icosa-2,4(8),9,13,15,17-hexaene|(6aR,12aalpha)-6a,12a-Dihydro-3-methoxy-6H-[1,3]dioxolo[5,6]benzofuro[3,2-c][1]benzopyran|16-methoxy-5,7,11,19-tetraoxapentacyclo(10.8.0.02,10.04,8.013,18)icosa-2,4(8),9,13(18),14,16-hexaene|6H-[1,3]Dioxolo[5,6]benzofuro[3,2-c][1]benzopyran, 6a,12a-dihydro-3-methoxy-, (6aR-cis)-|6H-[1,3]Dioxolo[5,6]benzofuro[3,2-c][1]benzopyran, 6a.alpha.,12a.alpha.-dihydro-3-methoxy-

CAS: 524-97-0
Molecular Formula C17H14O5
Molecular Weight 298.08414 g/mol
LogP 3.0336
Topological Polar Surface Area 46.15 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 1
Exact Mass 298.08414
Monoisotopic Mass 298.08414
Heavy Atoms 22
Complexity 769.8849

Chemical Identifiers

CAS Number 524-97-0
SMILES COC1=CC2=C(C=C1)[C@H]3[C@@H](CO2)C4=CC5=C(C=C4O3)OCO5

Product Overview

Pterocarpin (CAS 524-97-0), with molecular formula C17H14O5 and molecular weight 298.08414 g/mol. IUPAC: (1R,12R)-16-methoxy-5,7,11,19-tetraoxapentacyclo[10.8.0.02,10.04,8.013,18]icosa-2,4(8),9,13(18),14,16-hexaene.

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