Norgestimate and Ethinyl Estradiol
[(3E,8R,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-3-hydroxyimino-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl] acetate;(8R,9S,13S,14S,17R)-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
Molecular Identity
Norgestimate and Ethinyl Estradiol
[(3E,8R,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-3-hydroxyimino-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl] acetate;(8R,9S,13S,14S,17R)-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
PubChem CID: 9571023
2D Structure
Properties
C43H55NO5
Molecular Formula
665.90
Molecular Weight
g/mol
665.4080
Exact Mass
Da
99.4
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
6
H-Bond Acceptors
1250
Complexity
SMILES
Canonical SMILES
SMILES: CCC12CCC3C(C1CCC2(C#C)OC(=O)C)CCC4=CC(=NO)CCC34.CC12CCC3C(C1CCC2(C#C)O)CCC4=C3C=CC(=C4)OIsomeric SMILES
SMILES: CC[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)OC(=O)C)CCC4=C/C(=N/O)/CC[C@H]34.C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=C3C=CC(=C4)OSynonyms(20)
TRI-SPRINTECTricilesteOrtho Tri-CyclenPraminoPrevifemSprintecTricilestTri prevofemTri-previfemOrtho CylenTri CyclenOrtho Tri-CylenOrtho Tri LoTriNessa-28Cilest
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Norgestimate and Ethinyl Estradiol
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