Name: 17-ethyl-1,14-dihydroxy-12-[2'-(4"-(3'"-dioxolanylphenyloxy)-3"-methoxycyclohexyl)-1'-methylvinyl]-23,25-dimethoxy-13,19,21,27-tetramethyl-11,28-dioxa-4-azatricyclo[22.3.1.04,9 ]-octacos-18-ene-2,3,10,16-tetraone
SMILES:
CCC1C=C(C)CC(C)CC(OC)C2OC(O)(C(=O)C(=O)N3CCCCC3C(=O)OC(C(C)=CC3CCC(Oc4cccc(C5OCCO5)c4)C(OC)C3)C(C)C(O)CC1=O)C(C)CC2OCMolecular Processing
Molecular formula
C52H77NO14
Molecular weight
940.18
Exact mass
939.5344
XLogP
6.61
TPSA
185.82
H-bond donors
2
H-bond acceptors
14
Rotatable bonds
9
Heavy atoms
67
Rings
6
Aromatic rings
1
Saturated rings
4
Aliphatic rings
5
Stereo centers
14
Undefined stereo
14
Formal charge
0
Heteroatoms
15
Covalent units
1
Fraction Csp3
0.731
Molar refractivity
247.57
Supplementary Information
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