Try beta.chemspider
- 7 of 7 defined stereocentres
18-[(4-Aminobutyl)(3-amino-3-oxopropyl)amino]-18-oxooctadecyl (2S,2a'R,3'S,4'R,6''R,7S,8a'S)-7-ethyl-6''-methyl-1',2',2a',3',3'',4,4'',5'',6'',7,8',8a'-dodecahydro-3H,5'H-dispiro[oxepine-2,7'-[5,6,8b] triazaacenaphthylene-4',2''-pyran]-3'-carboxylate
CC[C@H]1C=CCC[C@]2(O1)C[C@@H]3CC[C@H]4N3C(=N[C@]5([C@H]4C(=O)OCCCCCCCCCCCCCCCCCC(=O)N(CCCCN)CCC(=O)N)CCC[C@H](O5)C)N2
InChI=1S/C47H82N6O6/c1-3-39-25-18-19-30-46(59-39)36-38-27-28-40-43(47(31-23-24-37(2)58-47)51-45(50-46)53(38)40)44(56)57-35-22-16-14-12-10-8-6-4-5-7-9-11-13-15-17-26-42(55)52(33-21-20-32-48)34-29-41(49)54/h18,25,37-40,43H,3-17,19-24,26-36,48H2,1-2H3,(H2,49,54)(H,50,51)/t37-,38+,39+,40-,43-,46+,47-/m1/s1
URSSOADZFTVGAG-XMXBVVCASA-N
CSID:29213299, http://www.chemspider.com/Chemical-Structure.29213299.html (accessed 13:36, 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
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