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AFRAMODIAL
PubChem ID
21668974
Chemical Name
AFRAMODIAL
Molecular Formula
C
20
H
30
O
3
Canonical SMILES
CC1(CCCC2(C1CCC3(C2CC=C(CC=O)C=O)CO3)C)C
IUPAC Name
(2E)-2-[2-[(1R,2S,4aS,8aS)-5,5,8a-trimethylspiro[3,4,4a,6,7,8-hexahydro-1H-naphthalene-2,2'-oxirane]-1-yl]ethylidene]butanedial
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
3
Molecular Weight
318.457 g/mol
XLogP
3.6
Rotatable Bond Count
5
Lipinsky's Rule of Five
Yes
Sources
Ginger
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2D SDF
3D SDF
mol
JPEG