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- 13 of 13 defined stereocentres
Methyl (betaS)-beta-acetoxy-N-[(3R)-3-hydroxy-3-methyl-5-oxo-5-{[(2alpha,3beta,12alpha,24R)-2,12,24,25-tetrahydroxylanost-8-en-3-yl]oxy}pentanoyl]-L-phenylalaninate
CC(=O)O[C@H]([C@H](NC(=O)C[C@@](C)(O)CC(=O)O[C@H]1[C@H](O)C[C@@]2(C)[C@@H](CCC3=C2C[C@H](O)[C@]2(C)[C@H](CC[C@]23C)[C@H](C)CC[C@@H](O)C(C)(C)O)C1(C)C)C(=O)OC)C1C=CC=CC=1
InChI=1S/C48H73NO12/c1-27(17-20-35(52)44(5,6)57)30-21-22-47(9)31-18-19-34-43(3,4)41(33(51)24-46(34,8)32(31)23-36(53)48(30,47)10)61-38(55)26-45(7,58)25-37(54)49-39(42(56)59-11)40(60-28(2)50)29-15-13-12-14-16-29/h12-16,27,30,33-36,39-41,51-53,57-58H,17-26H2,1-11H3,(H,49,54)/t27-,30-,33-,34+,35-,36+,39+,40+,41+,45-,46-,47+,48+/m1/s1
YNPPVMNLWLFSDD-DERQANKZSA-N
CSID:78442410, http://www.chemspider.com/Chemical-Structure.78442410.html (accessed 15:32, Jul 7, 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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