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- 8 of 9 defined stereocentres
benzyl N-[(1R)-1-[[(3S,6S,8S,12S,13R,16S,20S,23S)-12-hydroxy-3-isobutyl-8,13-diisopropyl-20-[(4-methoxyphenyl)methyl]-6,21-dimethyl-2,5,7,10,15,19,22-heptaoxo-9-oxa-1,4,14,18,21-pentazabicyclo[21.3.0]hexacosan-16-yl]carbamoyl]-3-methyl-butyl]-N-methyl-carbamate
O=C(OCc1ccccc1)N(C)[C@@H](C(=O)N[C@@H]3C(=O)N[C@@H]([C@@H](O)CC(=O)O[C@H](C(=O)[C@@H](C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)N(C)[C@H](C(=O)NC3)Cc4ccc(OC)cc4)CC(C)C)C)C(C)C)C(C)C)CC(C)C
InChI=1S/C55H81N7O13/c1-31(2)25-39-53(70)62-24-16-19-41(62)54(71)60(10)43(27-36-20-22-38(73-12)23-21-36)51(68)56-29-40(58-52(69)42(26-32(3)4)61(11)55(72)74-30-37-17-14-13-15-18-37)50(67)59-46(33(5)6)44(63)28-45(64)75-48(34(7)8)47(65)35(9)49(66)57-39/h13-15,17-18,20-23,31-35,39-44,46,48,63H,16,19,24-30H2,1-12H3,(H,56,68)(H,57,66)(H,58,69)(H,59,67)/t35-,39-,40-,41?,42+,43-,44-,46+,48-/m0/s1
YEAHGEVWZWSXEA-MJKNWMLDSA-N
CSID:8947754, http://www.chemspider.com/Chemical-Structure.8947754.html (accessed 03:46, Jul 4, 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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