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Chemical structure of Norelgestromin

GC33532

Norelgestromin

Also listed as Norgestimate metabolite Norelgestromin (17-Deacetyl norgestimate)

Norelgestromin is a metabolite of Norgestimate, which is a progestin or synthetic progestogen

ChemicalCAS53016-31-2MW327.46FormulaC21H29NO2
CAS number
53016-31-2
Molecular weight
327.46
Formula
C21H29NO2
Solubility
DMSO ： 20 mg/mL (61·08 mM; Need ultrasonic)
InChIKey
ISHXLNHNDMZNMC-XUDSTZEESA-N
Catalogue number
GC33532
Brand
GLPBIO
Computed properties PubChem CID 62930 · XLogP 3.6 · TPSA 52.8 Ų · H-bond donors 2
XLogP
3.6
TPSA
52.8 Ų
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
24

SMILES CC[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=CC(=NO)CC[C@H]34

Computed descriptors from PubChem (CID 62930), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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