CAS
76448-73-2 Purity
96%
76448-73-2 Purity
96%
![4-Benzoxazolecarboxylicacid,2-[[(2R,3R,6S,8S,9R,11R)-8-[(1S)-2-(4-bromo-1H-pyrrol-2-yl)-1-methyl-2-oxoethyl]-3,9,11-trimethyl-1,7-dioxaspiro[5.5]undec-2-yl]methyl]-5-(methylamino)-,[6s-[6a(2s*,3s*),8b](https://resource.alfa-chemistry.com/structure/76455-82-8.gif)
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11-Alpha,17-alpha,21-trihydroxy-16-alpha-methyl-5-alpha-pregnane-3,20-dione 21-acetate-11-(toluene-4-sulfonate)
CAS
7645-58-1
Catalog Number
ACM7645581
Category
Other Products
Molecular Weight
574.72538
Molecular Formula
C31H42O8S
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Specification
Synonyms
EINECS 231-585-2, CID111319, 11-alpha,17-alpha,21-Trihydroxy-16-alpha-methyl-5-alpha-pregnane-3,20-dione 21-acetate-11-(toluene-4-sulphonate), 7645-58-1
IUPAC Name
[2-[(5S,8S,9S,10S,11R,13S,14S,16R,17R)-17-hydroxy-10,13,16-trimethyl-11-(4-methylphenyl)sulfonyloxy-3-oxo-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
Canonical SMILES
CC1CC2C3CCC4CC(=O)CCC4(C3C(CC2(C1(C(=O)COC(=O)C)O)C)OS(=O)(=O)C5=CC=C(C=C5)C)C
InChI Key
BAOPJFFGWAXPHH-ROZYOPKOSA-N
EC Number
231-585-2
Exact Mass
574.26000
H-Bond Acceptor
8
H-Bond Donor
1
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