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Structure

Ethyl(3beta-acetoxy-17-azido-16alpha-hydroxypregn-5-en-20-ylidene)carbazate

CAS
63973-99-9
Catalog Number
ACM63973999
Category
Other Products
Molecular Weight
501.618360 [g/mol]
Molecular Formula
C26H39N5O5

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Specification

Synonyms
EINECS 264-586-1, CID9567940, Ethyl (3beta-acetoxy-17-azido-16alpha-hydroxypregn-5-en-20-ylidene)carbazate, 63973-99-9
IUPAC Name
[(3S,10R,13S,16R,17R)-17-azido-17-[(E)-N-(ethoxycarbonylamino)-C-methylcarbonimidoyl]-16-hydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate
Canonical SMILES
CCOC(=O)NN=C(C)C1(C(CC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C)C)C)O)N=[N+]=[N-]
InChI Key
MCZQQHKOLGEDPS-XSQZIVNASA-N
EC Number
264-586-1
Exact Mass
501.29500
H-Bond Acceptor
8
H-Bond Donor
2
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