이름: 10,13-dimethyl-6-prop-2-ynyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione

SMILES: CC12CCC3C(C1CCC2=O)CC(C4=CC(=O)CCC34C)CC#C

Molecular Processing

Molecular formula

C22H28O2

Molecular weight

324.46

Exact mass

324.2089

XLogP

4.34

TPSA

34.14

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

0.727

Molar refractivity

94.04

Supplementary Information

InChIKey: GFGIGWKDEBZVMT-UHFFFAOYSA-N

동의어

ICX5600105