NCS
China New Chemical Substance Search
Chenodeoxycholic acid
脱氧鹅胆酸
,
脱氧脲苷
,
3alpha,7alpha-二羟基-5beta-胆烷酸
,
3Α,7Α-二羟基-5Β-胆烷酸
,
护肝素
,
3α,7α-二羟基胆质酸
,
3α,7α-二羟基-5-β-胆烷酸, CDCA, Chenix, MFCD00064142, Chenodex, EINECS 207-481-8, Hekbilin, Fluibil, Ulmenide, Chenocol, chendol, Kebilis, anthropododesoxycholicacid, Chenodeoxycholic acid, 3α,7α-Dihydroxy-5β-cholanic Acid, Chendiol, 5β-Cholanic Acid-3α,7α-diol
CAS Number: 474-25-9
IUPAC name: (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]pentanoic acid
Molecular formula: C24H40O4
Molecular weight: 392.572
InChI: 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
InChIKey: RUDATBOHQWOJDD-BSWAIDMHSA-N
SMILES: -
EINECS: C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C
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