Try beta.chemspider
- 9 of 10 defined stereocentres
Methyl (3S,5S)-3,5-dihydroxy-7-{(1S,2R,3S,5R,6R,8S,8aR)-5-hydroxy-3-methoxy-2,6-dimethyl-8-[(2-methylbutanoyl)oxy]-1,2,3,5,6,7,8,8a-octahydro-1-naphthalenyl}heptanoate
CCC(C)C(=O)O[C@H]1C[C@@H](C)[C@@H](O)C2=C[C@@H](OC)[C@H](C)[C@H](CC[C@H](O)C[C@H](O)CC(=O)OC)[C@H]21
InChI=1S/C26H44O8/c1-7-14(2)26(31)34-22-10-15(3)25(30)20-13-21(32-5)16(4)19(24(20)22)9-8-17(27)11-18(28)12-23(29)33-6/h13-19,21-22,24-25,27-28,30H,7-12H2,1-6H3/t14?,15-,16-,17+,18+,19+,21-,22+,24-,25-/m1/s1
HEXISAIDDNYBOX-BIZSTCAJSA-N
CSID:78441278, http://www.chemspider.com/Chemical-Structure.78441278.html (accessed 14:21, Jun 16, 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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