Desmethoxy-beta-peltatin A methyl ether structure

Desmethoxy-beta-peltatin A methyl ether

(5aR,8aR,9R)-9-(3,4-dimethoxyphenyl)-4-methoxy-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-8-one

Also Known As: Desmethoxy-beta-peltatin A methyl ether|(5aR,8aR,9R)-9-(3,4-dimethoxyphenyl)-4-methoxy-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-8-one|(5R,5aR,8aR)-5-(3,4-Dimethoxyphenyl)-10-methoxy-5,8,8a,9-tetrahydro-2H-furo[3',4':6,7]naphtho[2,3-d][1,3]dioxol-6(5aH)-one

CAS: 32970-80-2
Molecular Formula C22H22O7
Molecular Weight 398.13657 g/mol
LogP 2.9183
Topological Polar Surface Area 72.45 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 7
Rotatable Bonds 4
Exact Mass 398.13657
Monoisotopic Mass 398.13657
Heavy Atoms 29
Complexity 983.61145

Chemical Identifiers

CAS Number 32970-80-2
SMILES COC1=C(C=C(C=C1)[C@H]2[C@@H]3[C@@H](CC4=C(C5=C(C=C24)OCO5)OC)COC3=O)OC

Product Overview

Desmethoxy-beta-peltatin A methyl ether (CAS 32970-80-2), with molecular formula C22H22O7 and molecular weight 398.13657 g/mol. IUPAC: (5aR,8aR,9R)-9-(3,4-dimethoxyphenyl)-4-methoxy-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-8-one.

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