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- Double-bond stereo
- 14 of 14 defined stereocentres
(1S,9R,12R,13S,14R,17S,18Z,21R,23R,24S,25R,27S)-17-Allyl-1,14-dihydroxy-12-{(1E)-1-[(1S,3S,4S)-4-hydroxy-3-methoxycyclohexyl]-1-propen-2-yl}-23,25-dimethoxy-13,19,21,27-tetramethyl-11,28-dioxa-4-azatr icyclo[22.3.1.0~4,9~]octacos-18-ene-2,3,10,16-tetrone hydrate (1:1)
O.CC1C[C@@H](C)C[C@@H](OC)[C@@H]2O[C@@](O)([C@@H](C)C[C@H]2OC)C(=O)C(=O)N2CCCC[C@@H]2C(=O)O[C@H]([C@@H](C)[C@H](O)CC(=O)[C@@H](CC=C)C=1)/C(/C)=C/[C@@H]1C[C@H](OC)[C@@H](O)CC1 |t:46|
InChI=1S/C44H69NO12.H2O/c1-10-13-31-19-25(2)18-26(3)20-37(54-8)40-38(55-9)22-28(5)44(52,57-40)41(49)42(50)45-17-12-11-14-32(45)43(51)56-39(29(6)34(47)24-35(31)48)27(4)21-30-15-16-33(46)36(23-30)53-7;/h10,19,21,26,28-34,36-40,46-47,52H,1,11-18,20,22-24H2,2-9H3;1H2/b25-19-,27-21+;/t26-,28+,29+,30-,31+,32-,33+,34-,36+,37-,38-,39+,40+,44+;/m1./s1
NWJQLQGQZSIBAF-QTZHMRQASA-N
CSID:110095232, http://www.chemspider.com/Chemical-Structure.110095232.html (accessed 21:34, Jun 9, 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
No predicted properties have been calculated for this compound.
Click to predict properties on the Chemicalize site
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