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- 7 of 11 defined stereocentres
[(1S,2E,4S,11E,13S,14E,16S,29E,32E,34S,35E,38E)-34-sec-Butyl-13-[(2R,3R)-3,4-dihydroxy-2-butanyl]-2,8,11,14,30,33,36,39-octahydroxy-27-oxido-5-oxo-27-thia-3,6,12,15,25,29,32,35,38-nonaazapentacyclo[14 .12.11.0~6,10~.0~18,26~.0~19,24~]nonatriaconta-2,11,14,18(26),19,21,23,29,32,35,38-undecaen-4-yl]acetic acid
CCC(C)[C@H]/1/C(=N\C/C(=N\[C@@H]/2CS(=O)c3c(c4ccccc4[nH]3)C[C@@H](/C(=N\C/C(=N1)/O)/O)/N=C(\[C@@H](/N=C(\C5CC(CN5C(=O)[C@@H](/N=C2/O)CC(=O)O)O)/O)[C@@H](C)[C@H](CO)O)/O)/O)/O
InChI=1S/C39H53N9O14S/c1-4-17(2)31-36(59)41-12-28(52)42-25-16-63(62)38-21(20-7-5-6-8-22(20)45-38)10-23(33(56)40-13-29(53)46-31)43-37(60)32(18(3)27(51)15-49)47-35(58)26-9-19(50)14-48(26)39(61)24(11-30(54)55)44-34(25)57/h5-8,17-19,23-27,31-32,45,49-51H,4,9-16H2,1-3H3,(H,40,56)(H,41,59)(H,42,52)(H,43,60)(H,44,57)(H,46,53)(H,47,58)(H,54,55)/t17?,18-,19?,23-,24-,25+,26?,27-,31-,32-,63?/m0/s1
QCZXQEYEVLCQHL-RUYXGJABSA-N
CSID:57262387, http://www.chemspider.com/Chemical-Structure.57262387.html (accessed 06:53, Apr 26, 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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