CCCCCCCCCCCCCCCCCCOc1cc(OCCCOc2cccc([N+](=O)[O-])c2)cc(C(=O)O)c1
SMILES: CCCCCCCCCCCCCCCCCCOc1cc(OCCCOc2cccc([N+](=O)[O-])c2)cc(C(=O)O)c1

Molecular Processing

Molecular formula
C34H51NO7
Molecular weight
585.78
Exact mass
585.3666
XLogP
9.78
TPSA
108.13
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
26
Heavy atoms
42
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.618
Molar refractivity
167.15

Supplementary Information

詳細情報を取得中…

2 件の反応に参加→

拡張検索

部分構造検索→類似構造検索→