Try beta.chemspider
- Charge
- Double-bond stereo
- 7 of 8 defined stereocentres
(2R,2a'R,5S,6''S,7'S,8'R,8a'S)-8'-[({16-[(4-Amino-2-hydroxybutyl)(3-aminopropyl)amino]-16-oxohexadecyl}oxy)carbonyl]-5-[(1E)-1-buten-1-yl]-6''-methyl-1',2',2a',3'',4,4'',5,5'',6',6'',8',8a'-dodecahydr o-3H,3'H,5'H-dispiro[furan-2,4'-[5,6]diaza[8b]azoniaacenaphthylene-7',2''-pyran]
C[C@H]1CCC[C@]2(NC3N[C@]4(C[C@H]5CC[C@@H]([C@H]2C(=O)OCCCCCCCCCCCCCCCC(=O)N(CC(O)CCN)CCCN)[N+]=35)CC[C@@H](/C=C/CC)O4)O1
InChI=1S/C45H80N6O6/c1-3-4-21-38-25-28-44(57-38)33-36-23-24-39-41(45(27-18-20-35(2)56-45)49-43(48-44)51(36)39)42(54)55-32-17-15-13-11-9-7-5-6-8-10-12-14-16-22-40(53)50(31-19-29-46)34-37(52)26-30-47/h4,21,35-39,41,52H,3,5-20,22-34,46-47H2,1-2H3,(H,48,49)/p+1/b21-4+/t35-,36+,37?,38+,39-,41-,44+,45-/m0/s1
CFUYXTKSADNOQH-ZJCPAICQSA-O
CSID:75590286, http://www.chemspider.com/Chemical-Structure.75590286.html (accessed 20:46, Aug 2, 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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