$CO/N=C1\C[C@H]2[C@@H]3CC45OCCOC4(OCCO5)[C@@]3(C)CC[C@@H]2[C@@]2(C)CCCC[C@]12O$

Name: 17,17-bis(ethylendioxy)-5α-hydroxy-6-(E)-methoxyiminoandrostane

SMILES: CO/N=C1\C[C@H]2[C@@H]3CC45OCCOC4(OCCO5)[C@@]3(C)CC[C@@H]2[C@@]2(C)CCCC[C@]12O

Molecular Processing

Molecular formula

C24H37NO6

Molecular weight

435.56

Exact mass

435.2621

XLogP

3.24

TPSA

78.74

H-bond donors

H-bond acceptors

Rotatable bonds

Heavy atoms

Rings

Aromatic rings

Saturated rings

Aliphatic rings

Stereo centers

Undefined stereo

Formal charge

Heteroatoms

Covalent units

Fraction Csp3

0.958

Molar refractivity

112.28

Supplementary Information

Details werden geladen…