GESTONORONE CAPROATE

Search structure
Synonyms:
Status: Approved
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: U38E620NS6

Structure
InChI Key XURCMZMFZXXQDJ-UKNJCJGYSA-N
Smile CCCCCC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C
InChI
InChI=1S/C26H38O4/c1-4-5-6-7-24(29)30-26(17(2)27)15-13-23-22-10-8-18-16-19(28)9-11-20(18)21(22)12-14-25(23,26)3/h16,20-23H,4-15H2,1-3H3/t20-,21+,22+,23-,25-,26-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C26H38O4
Molecular Weight 414.59
AlogP 5.58
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 6.0
Polar Surface Area 60.44
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 30.0

Related Entries

Scaffolds

Cross References

Resources Reference
ChEBI 31650
ChEMBL CHEMBL2107389
DrugBank DB14677
DrugCentral 3261
FDA SRS U38E620NS6
PubChem 443881
SureChEMBL SCHEMBL147685
ZINC ZINC000004216396
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