Try beta.chemspider
- Double-bond stereo
- 7 of 7 defined stereocentres
Methyl (3S,4S,13R,14R,21R)-9-acetyl-14-ethyl-4,8,13,18-tetramethyl-20-oxo-3-(3-oxo-3-{[(2Z,7S,11S)-3,7,11,15-tetramethyl-2-hexadecen-1-yl]oxy}propyl)-13,14,24,26-tetrahydro-21-phorbinecarboxylate
CCC\1C(/C/2=C/c3c(c(c([nH]3)/C=C\4/C(C(/C(=C\5/c6c(c(c([nH]6)/C=C1\N2)C)C(=O)C5C(=O)OC)/N4)CCC(=O)OCC=C(C)CCCC(C)CCCC(C)CCCC(C)C)C)C)C(=O)C)C
InChI=1S/C55H78N4O6/c1-13-39-34(7)41-29-46-48(38(11)60)36(9)43(57-46)27-42-35(8)40(52(58-42)50-51(55(63)64-12)54(62)49-37(10)44(59-53(49)50)28-45(39)56-41)23-24-47(61)65-26-25-33(6)22-16-21-32(5)20-15-19-31(4)18-14-17-30(2)3/h25,27-32,34-35,39-40,51,56-59H,13-24,26H2,1-12H3/b33-25?,41-29-,42-27-,45-28-,52-50-/t31-,32-,34+,35-,39+,40-,51+/m0/s1
DHJJQDBRYIGLJP-FHULEDTESA-N
CSID:61715791, http://www.chemspider.com/Chemical-Structure.61715791.html (accessed 15:58, May 21, 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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