Try beta.chemspider
- 12 of 12 defined stereocentres
- Non-standard isotope
(3alpha,5beta,6beta,7beta,12alpha)-3,6,7,12-Tetrahydroxy(11,11,12-~2~H_3_)cholan-24-oic acid
C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](C([2H])([2H])[C@@]([2H])([C@]12C)O)[C@@]4(C)CC[C@H](C[C@H]4[C@@H]([C@@H]3O)O)O [2H][C@]1([C@]2([C@@H](CC[C@@H]2[C@H](C)CCC(=O)O)[C@@H]3[C@H]([C@H]([C@@H]4C[C@@H](CC[C@@]4([C@H]3C1([2H])[2H])C)O)O)O)C)O
InChI=1S/C24H40O6/c1-12(4-7-19(27)28)14-5-6-15-20-16(11-18(26)24(14,15)3)23(2)9-8-13(25)10-17(23)21(29)22(20)30/h12-18,20-22,25-26,29-30H,4-11H2,1-3H3,(H,27,28)/t12-,13-,14-,15+,16+,17+,18+,20+,21+,22-,23-,24-/m1/s1/i11D2,18D
COCMFMBNEAMQMA-MXBKAELISA-N
CSID:58784468, http://www.chemspider.com/Chemical-Structure.58784468.html (accessed 23:11, Apr 25, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
Click to predict properties on the Chemicalize site
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