Try beta.chemspider
- 9 of 10 defined stereocentres
Methyl (7alpha,12alpha)-7,12-bis(benzoyloxy)-3-oxocholan-24-oate
C[C@H](CCC(=O)OC)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](OC(=O)C4C=CC=CC=4)[C@@]21C)[C@@]1(C)CCC(=O)CC1C[C@H]3OC(=O)C1C=CC=CC=1
InChI=1S/C39H48O7/c1-24(15-18-34(41)44-4)29-16-17-30-35-31(23-33(39(29,30)3)46-37(43)26-13-9-6-10-14-26)38(2)20-19-28(40)21-27(38)22-32(35)45-36(42)25-11-7-5-8-12-25/h5-14,24,27,29-33,35H,15-23H2,1-4H3/t24-,27?,29-,30+,31+,32-,33+,35+,38+,39-/m1/s1
PBFPOGTVDCJJQR-AEAVCORPSA-N
CSID:129188243, http://www.chemspider.com/Chemical-Structure.129188243.html (accessed 14:00, May 21, 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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