Try beta.chemspider
- Double-bond stereo
- 9 of 9 defined stereocentres
CN1CCN(CC1)N/C=C1\C2NC(=O)C(C)=CC=C[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(C)=O)[C@H](C)[C@H](C=CO[C@@]3(C)OC4=C(C(=C(C=2O)C(O)=C4C)C\1=O)C3=O)OC.NC(=O)C1=CN=CC=N1.NNC(=O)C1C=CN=CC=1 |c:16,18,38|
InChI=1S/C43H58N4O12.C6H7N3O.C5H5N3O/c1-21-12-11-13-22(2)42(55)45-33-28(20-44-47-17-15-46(9)16-18-47)37(52)30-31(38(33)53)36(51)26(6)40-32(30)41(54)43(8,59-40)57-19-14-29(56-10)23(3)39(58-27(7)48)25(5)35(50)24(4)34(21)49;7-9-6(10)5-1-3-8-4-2-5;6-5(9)4-3-7-1-2-8-4/h11-14,19-21,23-25,29,34-35,39,44,49-51,53H,15-18H2,1-10H3,(H,45,55);1-4H,7H2,(H,9,10);1-3H,(H2,6,9)/b12-11-,19-14-,22-13-,28-20+;;/t21-,23+,24+,25+,29-,34-,35+,39+,43-;;/m0../s1
ISQNHBQZTYOGKM-QVPPGHRSSA-N
CSID:114551571, http://www.chemspider.com/Chemical-Structure.114551571.html (accessed 14:12, Jun 16, 2024)
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
No predicted properties have been calculated for this compound.
Click to predict properties on the Chemicalize site
Advertisement
Spotlight