Try beta.chemspider
- Double-bond stereo
- 29 of 31 defined stereocentres
[O-][N+](=O)[C@]1(C)C[C@H](O[C@@H](C)[C@H]1NC(=O)OC)O[C@@H]3C(=C/[C@@H]%10/C=C(/CO)[C@H](C)C[C@@]2%10OC(\O)=C(/C2=O)C(=O)[C@]4(C)[C@@H](C(=C/C3)\C)/C=C\C9C4[C@@H](C)C[C@H](C)[C@@H]9O[C@H]8O[C@H](C)[C@@H](O)[C@@H](O[C@H]7O[C@@H]([C@@H](O[C@@H]5O[C@H](C)[C@@H](OC)[C@@H](O)C5)[C@@H](O[C@@H]6O[C@H]([C@H](O)[C@H](O)C6)C)C7)C)C8)/C
InChI=1S/C67H100N2O24/c1-29-15-18-45(88-52-27-65(11,69(79)80)60(38(10)87-52)68-64(78)82-14)30(2)20-40-21-39(28-70)33(5)26-67(40)62(76)53(63(77)93-67)61(75)66(12)42(29)17-16-41-54(66)31(3)19-32(4)57(41)91-51-24-46(56(74)35(7)84-51)89-50-25-47(90-48-22-43(71)55(73)34(6)83-48)59(37(9)86-50)92-49-23-44(72)58(81-13)36(8)85-49/h15-17,20-21,31-38,40-52,54-60,70-74,77H,18-19,22-28H2,1-14H3,(H,68,78)/b29-15-,30-20+/t31-,32-,33+,34-,35+,36+,37+,38-,40+,41?,42+,43+,44-,45-,46-,47-,48-,49-,50+,51+,52+,54?,55-,56+,57-,58+,59+,60+,65+,66+,67-/m0/s1
HWLALZIEGGFXKV-SGEREXJVSA-N
CSID:8504521, http://www.chemspider.com/Chemical-Structure.8504521.html (accessed 02:43, Jul 6, 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