Structure Database (LMSD)
Common Name
(-)-Euphomine
Systematic Name
Synonyms
3D model of (-)-Euphomine
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
Level 4 Class
String Representations
InChiKey (Click to copy)
KJAZUSMSKFLAQW-LMRGBCEQSA-N
InChi (Click to copy)
InChI=1S/C32H44O8/c1-19-14-15-31(7,8)28(38-23(5)34)17-27(37-22(4)33)20(2)16-26-29(40-25-12-10-9-11-13-25)21(3)18-32(26,36)30(19)39-24(6)35/h9-16,19,21,26-30,36H,17-18H2,1-8H3/b15-14+,20-16+/t19-,21-,26-,27?,28?,29-,30?,32+/m0/s1
SMILES (Click to copy)
[C@@]12([H])C=C(C)C(OC(=O)C)CC(OC(=O)C)C(C)(C)C=C[C@H](C)C(OC(=O)C)[C@@]1(O)C[C@H](C)[C@@H]2OC1C=CC=CC=1
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
40
Rings
3
Aromatic Rings
1
Rotatable Bonds
8
Van der Waals Molecular Volume
563.38
Topological Polar Surface Area
108.36
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
8
logP
6.62
Molar Refractivity
152.76
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Created at
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Updated at
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