Rubropunctatin

(9aR)-3-hexanoyl-9a-methyl-6-[(E)-prop-1-enyl]furo[3,2-g]isochromene-2,9-dione

Also Known As: Rubropunctatin|Rubropunctatine|Rubropuncatatin|ESTRIOL SUCCINATE|MSK2461|HY-N7766|(9aR)-3-hexanoyl-9a-methyl-6-[(E)-prop-1-enyl]furo[3,2-g]isochromene-2,9-dione|(R,E)-3-Hexanoyl-9a-methyl-6-(prop-1-en-1-yl)-2H-furo[3,2-g]isochromene-2,9(9aH)-dione|(R-(E))-9a-Methyl-3-(1-oxohexyl)-6-(1-propenyl)-2H-furo(3,2-g)(2)benzopyran-2,9(9aH)-dione|2H-Furo(3,2-g)(2)benzopyran-2,9(9aH)-dione, 9a-methyl-3-(1-oxohexyl)-6-(1-propenyl)-, (R-(E))-|(9aR)-3-hexanoyl-9a-methyl-6-((E)-prop-1-enyl)furo(3,2-g)isochromene-2,9-dione|(9aR)-3-hexanoyl-9a-methyl-6-[(E)-prop-1-enyl]uro[3,2-g]isochromene-2,9-dione|(9AR)-3-HEXANOYL-9A-METHYL-6-[(1E)-PROP-1-EN-1-YL]-2H,9H,9AH-FURO[3,2-G]ISOCHROMENE-2,9-DIONE|(9aR)-9a-Methyl-3-hexanoyl-6-[(E)-1-propenyl]-2H-furo[3,2-g][2]benzopyran-2,9(9aH)-dione|(R)-9a-Methyl-3-(1-oxohexyl)-6-[(E)-1-propenyl]-2H-furo[3,2-g][2]benzopyran-2,9(9aH)-dione|2H-Furo[3,2-g][2]benzopyran-2,9(9aH)-dione, 9a-methyl-3-(1-oxohexyl)-6-(1E)-1-propen-1-yl-, (9aR)-

Molecular Formula	C21H22O5
Molecular Weight	354.14673 g/mol
LogP	3.6311
Topological Polar Surface Area	69.67 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	6
Exact Mass	354.14673
Monoisotopic Mass	354.14673
Heavy Atoms	26
Complexity	834.46277

Chemical Identifiers

CAS Number	514-67-0
SMILES	CCCCCC(=O)C1=C2C=C3C=C(OC=C3C(=O)[C@@]2(OC1=O)C)/C=C/C