Nicandrenone

cas: 40071-64-5 — see every product listed under this CAS number, including other names

Nicandrenone (CAS 40071-64-5) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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cas40071-64-5
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Structural formula: {0} (CAS {1})

(1R,2S,4S,5R,10R,11S)-5-hydroxy-16-[(1S)-1-[(1S,2R,6S)-2-hydroxy-1,6-dimethyl-3,7-dioxabicyclo[4.1.0]heptan-4-yl]ethyl]-10-methyl-3-oxapentacyclo[9.8.0.02,4.05,10.014,19]nonadeca-7,14(19),15,17-tetraen-9-one (CAS 40071-64-5) is a chemical compound with the molecular formula C28H34O6 and a molecular weight of 466.6 g/mol. IUPAC name: (1R,2S,4S,5R,10R,11S)-5-hydroxy-16-[(1S)-1-[(1S,2R,6S)-2-hydroxy-1,6-dimethyl-3,7-dioxabicyclo[4.1.0]heptan-4-yl]ethyl]-10-methyl-3-oxapentacyclo[9.8.0.02,4.05,10.014,19]nonadeca-7,14(19),15,17-tetraen-9-one. InChIKey: PWHVEHULNLETOV-FBGLMBAISA-N.

Identity
Molecular formulaC28H34O6
Molecular weight466.6 g/mol
IUPAC name(1R,2S,4S,5R,10R,11S)-5-hydroxy-16-[(1S)-1-[(1S,2R,6S)-2-hydroxy-1,6-dimethyl-3,7-dioxabicyclo[4.1.0]heptan-4-yl]ethyl]-10-methyl-3-oxapentacyclo[9.8.0.02,4.05,10.014,19]nonadeca-7,14(19),15,17-tetraen-9-one
InChIKeyPWHVEHULNLETOV-FBGLMBAISA-N
SMILESC[C@H](C1C[C@]2([C@](O2)([C@@H](O1)O)C)C)C3=CC4=C(C=C3)[C@H]5[C@H](CC4)[C@]6(C(=O)C=CC[C@@]6([C@@H]7[C@H]5O7)O)C

Computed by PubChem (NCBI)

Synonyms: Nicandrenone

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