METHYL CHOLATE ,1448-36-8 _Chemical Cloud Database

METHYL CHOLATE

Basic Information
Product Name：	METHYL CHOLATE
CAS：	1448-36-8
English Synonyms：	METHYL 4-(3,7,12-TRIHYDROXY-10,13-DIMETHYLPERHYDROCYCLOPENTA[A]PHENANTHREN-17-YL)PENTANOATE ; 5BETA-CHOLANIC ACID-3ALPHA,7ALPHA,12ALPHA-TRIOL METHYL ESTER ; METHYL CHOLATE ; CHOLIC ACID METHYL ESTER ; 5(BETA)-CHOLAMIC ACID-3ALPHA,7ALPHA,12ALPHA-TRIOL METHYL ESTER ; CHOLAN-24-OIC ACID, 3,7,12-TRIHYDROXY-, METHYL ESTER, (3ALPHA,5BETA,7ALPHA,12ALPHA)-
MDL Number.：	MFCD00064934
H bond acceptor：	5
H bond donor：	3
Smile：	C[C@H](CCC(=O)OC)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C
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
InChiKey：	InChIKey=DLYVTEULDNMQAR-SRNOMOOLSA-N
Property
Melting Point：	155-156 DEG C/155-156°C
Comments：	BRN: 2226989 EINECS: 215-903-7 MERCK: 14,2203 UNSPSC: 12352106
Safety information

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