Try beta.chemspider
- 10 of 10 defined stereocentres
2,8-Diamino-N,N'-bis[(6S,9R,10S,13R,18aS)-6,13-diisopropyl-2,5,9-trimethyl-1,4,7,11,14-pentaoxohexadecahydro-1H-pyrrolo[2,1-i][1,4,7,10,13]oxatetraazacyclohexadecin-10-yl]-4,6-dimethyl-3-oxo-3H-phenox azine-1,9-dicarboxamide
O=C2N1CCC[C@H]1C(=O)N(C)CC(=O)N(C)[C@H](C(=O)O[C@H](C)[C@@H](C(=O)N[C@@H]2C(C)C)NC(=O)c3c(N)cc(c4O\C\5=C(\C(=O)C(\N)=C(C/5=N\c34)C(=O)N[C@@H]7C(=O)N[C@@H](C(=O)N6CCC[C@H]6C(=O)N(C)CC(=O)N(C)[C@H](C(=O)O[C@@H]7C)C(C)C)C(C)C)C)C)C(C)C
InChI=1S/C62H87N13O16/c1-26(2)42-59(85)74-21-17-19-35(74)57(83)70(13)24-37(76)72(15)48(28(5)6)61(87)89-32(11)44(55(81)66-42)68-53(79)39-34(63)23-30(9)51-46(39)65-47-40(41(64)50(78)31(10)52(47)91-51)54(80)69-45-33(12)90-62(88)49(29(7)8)73(16)38(77)25-71(14)58(84)36-20-18-22-75(36)60(86)43(27(3)4)67-56(45)82/h23,26-29,32-33,35-36,42-45,48-49H,17-22,24-25,63-64H2,1-16H3,(H,66,81)(H,67,82)(H,68,79)(H,69,80)/t32-,33-,35+,36+,42-,43-,44+,45+,48+,49+/m1/s1
UABQYPVNWHRLLW-WFZSUFIYSA-N
CSID:8572048, http://www.chemspider.com/Chemical-Structure.8572048.html (accessed 04:52, Jun 1, 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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