Try beta.chemspider
- Double-bond stereo
- 7 of 8 defined stereocentres
Methyl (3S,4S,13R,14R,21R)-9-acetyl-14-ethyl-4,8,13,18-tetramethyl-20-oxo-3-(3-oxo-3-{[(3S,7R,8E,11S)-3,7,11,15-tetramethyl-8-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)OCCC(C)CCCC(C)C=CCC(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/h15,20,27-35,39-40,51,56-59H,13-14,16-19,21-26H2,1-12H3/b20-15?,41-29-,42-27-,45-28-,52-50-/t31-,32-,33?,34+,35-,39+,40-,51+/m0/s1
CIJUDYZIMMIPFP-ZRIHRCPNSA-N
CSID:61712589, http://www.chemspider.com/Chemical-Structure.61712589.html (accessed 05:43, Jun 18, 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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