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Estriol-D6 sulfate glucuronide

Chemical Name Estriol-D6 sulfate glucuronide
CAT No. CS-O-13927
CAS Registry# 4661-65-8 (Unlabeled)
Status Under Certification (Usually dispatched in 5 days)
Category Stable Isotopes
Hazardous This is not a Hazardous Compound
COA View Sample COA
Controlled No

Additional Information


Controlled No
Parent API Estriol
Smileys C[C@@]1([C@@]2([2H])O)C(C[C@@]2([2H])OC([C@@H]([C@@H](O)[C@@H]3O)O)O[C@@H]3C(O)=O)C(CC([2H])C4=C5C=C([2H])C(O[S](=O)(O)=O)=C4[2H])[C@]5([2H])CC1
Canonical Smiles CC12CCC3C(C1CC(C2O)OC4C(C(C(C(O4)C(=O)O)O)O)O)CCC5=C3C=CC(=C5)OS(=O)(=O)O
InchIKey ATNWFRGUDKUYOG-SUPAOECSSA-N
Inchl InChI=1S/C24H32O12S/c1-24-7-6-13-12-5-3-11(36-37(31,32)33)8-10(12)2-4-14(13)15(24)9-16(21(24)28)34-23-19(27)17(25)18(26)20(35-23)22(29)30/h3,5,8,13-21,23,25-28H,2,4,6-7,9H2,1H3,(H,29,30)(H,31,32,33)/t13-,14-,15+,16-,17+,18+,19-,20+,21+,23?,24+/m1/s1
IUPAC (2S,3S,4S,5R)-3,4,5-trihydroxy-6-[[(8R,9S,13S,14S,16R,17R)-17-hydroxy-13-methyl-3-sulfooxy-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-16-yl]oxy]oxane-2-carboxylic acid
Hazardous No


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