- 4 of 5 defined stereocentres
(3S,6S,9S,15aR)-9-[(2S)-2-Butanyl]-6-[(1-methoxy-1H-indol-3-yl)methyl]-3-(7-oxooctyl)octahydro-2H-pyrido[1,2-a][1,4,7,10]tetraazacyclododecine-1,4,7,10(3H,12H)-tetrone
O=C2N1CCCC[C@@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H]2C(C)CC)Cc4c3ccccc3n(OC)c4)CCCCCCC(=O)C
InChI=1S/C34H49N5O6/c1-5-22(2)30-34(44)38-19-13-12-18-29(38)33(43)35-26(16-9-7-6-8-14-23(3)40)31(41)36-27(32(42)37-30)20-24-21-39(45-4)28-17-11-10-15-25(24)28/h10-11,15,17,21-22,26-27,29-30H,5-9,12-14,16,18-20H2,1-4H3,(H,35,43)(H,36,41)(H,37,42)/t22?,26-,27-,29+,30-/m0/s1
ZIJAVZNCLZBCDK-LQJYRIKDSA-N
CSID:9072698, http://www.chemspider.com/Chemical-Structure.9072698.html (accessed 08:31, Apr 19, 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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