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- 5 of 7 defined stereocentres
(1E,4E,6S,7E,9R,10E,12R,13E,15R,19S)-9-(4-Aminobutyl)-15-benzyl-12-[4-(benzyloxy)benzyl]-1,4,7,10,13-pentahydroxy-6-(1H-indol-3-ylmethyl)-16-oxo-3-phenyl-3,6,9,12,15,16,18,19,20,20a-decahydropyrrolo[1 ,2-a][1,4,7,10,13,16]hexaazacyclooctadecin-19-yl hydrogen (2-aminoethyl)carbonimidate
c1ccc(cc1)C[C@@H]/2C(=O)N3C[C@H](CC3/C(=N\C(/C(=N\[C@H](/C(=N\[C@@H](/C(=N\[C@@H](/C(=N2)/O)Cc4ccc(cc4)OCc5ccccc5)/O)CCCCN)/O)Cc6c[nH]c7c6cccc7)/O)c8ccccc8)/O)OC(=NCCN)O
InChI=1S/C58H66N10O9/c59-27-13-12-22-46-52(69)64-47(30-38-23-25-42(26-24-38)76-36-39-16-6-2-7-17-39)53(70)66-49(31-37-14-4-1-5-15-37)57(74)68-35-43(77-58(75)61-29-28-60)33-50(68)55(72)67-51(40-18-8-3-9-19-40)56(73)65-48(54(71)63-46)32-41-34-62-45-21-11-10-20-44(41)45/h1-11,14-21,23-26,34,43,46-51,62H,12-13,22,27-33,35-36,59-60H2,(H,61,75)(H,63,71)(H,64,69)(H,65,73)(H,66,70)(H,67,72)/t43-,46+,47+,48-,49+,50?,51?/m0/s1
VMZMNAABQBOLAK-HJEJEYQFSA-N
CSID:57643251, http://www.chemspider.com/Chemical-Structure.57643251.html (accessed 04:37, 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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