- 9 of 12 defined stereocentres
N-Acetyl-N-methyl-L-valyl-(4R)-N,4-dimethyl-N-[(2R,6S,9S,16S,24S,27S)-6,16,27-triisobutyl-24-isopropyl-2,10,17,25-tetramethyl-5,8,12,15,18,23,26,29-octaoxohexacosahydro-1H,12H-dipyrrolo[2,1-i:2',1'-r] [1,4,7,10,13,16,19,22]oxaheptaazacyclopentacosin-9-yl]prolinamide
C[C@@H]1C[C@H](N(C1)C(=O)[C@H](C(C)C)N(C)C(=O)C)C(=O)N(C)[C@H]2C(OC(=O)CNC(=O)[C@@H](N(C(=O)C3CCCN3C(=O)[C@@H](N(C(=O)[C@@H](NC(=O)C4C[C@H](CN4C(=O)[C@@H](NC2=O)CC(C)C)C)CC(C)C)C)C(C)C)C)CC(C)C)C
InChI=1S/C57H96N10O12/c1-30(2)22-39-52(73)63(17)47(34(9)10)56(77)65-21-19-20-41(65)54(75)62(16)42(24-32(5)6)49(70)58-27-45(69)79-37(13)48(51(72)60-40(23-31(3)4)53(74)66-28-35(11)25-43(66)50(71)59-39)64(18)55(76)44-26-36(12)29-67(44)57(78)46(33(7)8)61(15)38(14)68/h30-37,39-44,46-48H,19-29H2,1-18H3,(H,58,70)(H,59,71)(H,60,72)/t35-,36-,37?,39+,40+,41?,42+,43?,44+,46+,47+,48+/m1/s1
JSNIAKPKPNJUEP-IAWBKRGRSA-N
CSID:4572416, http://www.chemspider.com/Chemical-Structure.4572416.html (accessed 00:55, Mar 29, 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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