Try beta.chemspider
- Double-bond stereo
- 9 of 11 defined stereocentres
2-Oxo-2-{[(7S,9E,11S,12R,13S,14R,15R,16R,17S,18S)-6,15,17,27,29-pentahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-26-(4-morpholinyl)-2,23-dioxo-8,30-dioxa-24-azatetracyclo[23.3.1.1~4,7~.0~5,28~]t riaconta-3,5,9,19,21,25(29),26-heptaen-13-yl]oxy}ethyl (1-methyl-1,4-dihydro-3-pyridinyl)acetate
C[C@H]1/C=C/C=C(\C(=O)NC2=C(C3C(C4=C([C@@](O/C=C/[C@@H]([C@H]([C@H]([C@@H]([C@@H]([C@@H]([C@H]1O)C)O)C)OC(=O)COC(=O)CC5=CN(C=CC5)C)C)OC)(OC4=C(C3=O)C)C)O)C(=C2N6CCOCC6)O)O)/C
InChI=1S/C49H65N3O15/c1-25-12-10-13-26(2)48(61)50-38-39(52-17-20-63-21-18-52)44(59)35-36(43(38)58)42(57)30(6)46-37(35)47(60)49(7,67-46)65-19-15-32(62-9)27(3)45(29(5)41(56)28(4)40(25)55)66-34(54)24-64-33(53)22-31-14-11-16-51(8)23-31/h10-13,15-16,19,23,25,27-29,32,35-36,40-41,45,55-56,58-60H,14,17-18,20-22,24H2,1-9H3,(H,50,61)/b12-10+,19-15+,26-13+/t25-,27+,28+,29+,32-,35?,36?,40-,41+,45+,49-/m0/s1
LXYIIEKJPCKWGS-WAMLSSCUSA-N
CSID:4883448, http://www.chemspider.com/Chemical-Structure.4883448.html (accessed 06:18, 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
Advertisement
Spotlight