Try beta.chemspider
- 7 of 8 defined stereocentres
(3S,9S,13S,16S,19S)-16-Benzyl-3,19-di[(2S)-2-butanyl]-13-isopropyl-10,10,15-trimethyl-9-(4-penten-1-yl)dodecahydro-1H,9H-pyrrolo[2,1-i][1,13,4,7,10,16,19]dioxapentaazacyclodocosine-1,4,7,11,14,17,20(1 0H,19H)-heptone
CC[C@H](C)[C@H]1C(=O)NCC(=O)O[C@H](C(C(=O)N[C@H](C(=O)N([C@H](C(=O)O[C@H](C(=O)N2CCCC2C(=O)N1)[C@@H](C)CC)Cc3ccccc3)C)C(C)C)(C)C)CCCC=C
InChI=1S/C44H67N5O9/c1-11-14-16-23-33-44(8,9)43(56)47-35(27(4)5)40(53)48(10)32(25-30-20-17-15-18-21-30)42(55)58-37(29(7)13-3)41(54)49-24-19-22-31(49)38(51)46-36(28(6)12-2)39(52)45-26-34(50)57-33/h11,15,17-18,20-21,27-29,31-33,35-37H,1,12-14,16,19,22-26H2,2-10H3,(H,45,52)(H,46,51)(H,47,56)/t28-,29-,31?,32-,33-,35-,36-,37-/m0/s1
WXTNWSNJAHRKRT-JZLULZLYSA-N
CSID:2281401, http://www.chemspider.com/Chemical-Structure.2281401.html (accessed 12:56, Jun 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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