Methyl Cholate

CAT: 0572-TRC-M294475-500MGSize: 500 mgDry Ice: NoHazardous: No
CAT#:0572-TRC-M294475-500MGSize:500 mg
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CAS Number
1448-36-8
Synonyms
Methyl Cholate; Cholan-24-oic acid, 3,7,12-trihydroxy-, methyl ester, (3α,5β,7α,12α)-; Cholic acid, methyl ester (6CI,7CI,8CI); Methyl 3α,7α,12α-trihydroxy-5β-cholan-24-ate; Methyl 3α,7α,12α-trihydroxy-5β-cholan-24-oate; Methyl 3α,7α,12α-trihydroxy-5β-cholanoate; Methyl cholate; NSC 126794
Hazard Statement
No Data Available
Purity
>95% (HPLC)
Smiles
COC(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C
Molecular Formula
C25 H42 O5
Molecular Weight
422.6
InChI
InChI=1S/C25H42O5/c1-14(5-8-22(29)30-4)17-6-7-18-23-19(13-21(28)25(17,18)3)24(2)10-9-16(26)11-15(24)12-20(23)27/h14-21,23,26-28H,5-13H2,1-4H3/t14-,15+,16-,17-,18+,19+,20-,21+,23+,24+,25-/m1/s1
Additionnal Information
IUPAC name: methyl (4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

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