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segesterone acetate

Structure via PubChem · Public domain (PubChem)

EntityQ1978481· pop 6· linked from 618 articles

segesterone acetate

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Also known as Nestorone, 16-methylene-17α-acetoxy-19-norprogesterone

chemical compound

Chemical data

Formula
C23H30O4
Molecular weight
370.5 g/mol
IUPAC name
[(8R,9S,10R,13S,14S,17R)-17-acetyl-13-methyl-16-methylidene-3-oxo-2,6,7,8,9,10,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate
SMILES
CC(=O)[C@]1(C(=C)C[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@H]34)C)OC(=O)C
InChIKey
CKFBRGLGTWAVLG-GOMYTPFNSA-N
XLogP
2.9
Polar surface area
60.4 Ų
H-bond donors
0
H-bond acceptors
4
Formal charge
0

via PubChem

Drug data · ChEMBL

Max clinical phase
Approved
Molecule type
Small molecule
First approval
2018
Admin. routes
topical

via ChEMBL · EBI

Wikidata facts

Mass
370.214
Show 4 more facts
Commons category
Segesterone acetate
chemical formula
C₂₃H₃₀O₄
canonical SMILES
CC(=O)C1(C(=C)CC2C1(CCC3C2CCC4=CC(=O)CCC34)C)OC(=O)C
isomeric SMILES
CC(=O)[C@]1(C(=C)C[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@H]34)C)OC(=O)C
Sources (3)

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via Wikidata sitelinks · CC0