CC1=CC(=O)CC(C)(C)C1.CCC1=C(CC)C(=O)NC1=O.CCOC(N)=O.CCOC(N)=O
SMILES: CC1=CC(=O)CC(C)(C)C1.CCC1=C(CC)C(=O)NC1=O.CCOC(N)=O.CCOC(N)=O

Molecular Processing

Molecular formula
C23H39N3O7
Molecular weight
469.58
Exact mass
469.2788
XLogP
3.28
TPSA
167.88
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
33
Rings
2
Aromatic rings
0
Saturated rings
0
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
4
Fraction Csp3
0.609
Molar refractivity
124.96

Supplementary Information

詳細情報を取得中…

4 件の反応に参加→

拡張検索

部分構造検索→類似構造検索→