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Chenodeoxycholic Acid 13C

Chemical Name Chenodeoxycholic Acid 13C
CAT No. CS-BE-00026
CAS Registry# 52918-92-0
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 Chenodeoxycholic acid
Smileys C[C@@]1([C@@]2([H])[C@H](C)CC[13C](O)=O)[C@](CC2)([H])[C@@]([C@@H](C[C@]3([H])C[C@H](O)CC4)O)([H])[C@]([C@]34C)([H])CC1
Canonical Smiles CC(CCC(=O)O)C1CCC2C1(CCC3C2C(CC4C3(CCC(C4)O)C)O)C
InchIKey RUDATBOHQWOJDD-NIOAGLPLSA-N
Inchl InChI=1S/C24H40O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17-,18+,19+,20-,22+,23+,24-/m1/s1/i21+1
IUPAC (4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl](113C)pentanoic acid
Hazardous No


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