Compound-ID | 8479 |
Common Name | Lauroyl-KDO2-lipid IV(A) |
InChI |
InChI=1/C96H176N2O38P2/c1-6-11-16-21-26-31-36-41-46-51-66(101)56-76(107)97-81-89(130-79(110)57-67(102)52-47-42-37-32-27-22-17-12-7-2)85(114)74(128-92(81)136-138(122,123)124)64-125-91-82(98-77(108)59-69(54-49-44-39-34-29-24-19-14-9-4)127-78(109)55-50-45-40-35-30-25-20-15-10-5)90(131-80(111)58-68(103)53-48-43-38-33-28-23-18-13-8-3)88(135-137(119,120)121)75(129-91)65-126-95(93(115)116)61-73(84(113)87(133-95)72(106)63-100)132-96(94(117)118)60-70(104)83(112)86(134-96)71(105)62-99/h66-75,81-92,99-106,112-114H,6-65H2,1-5H3,(H,97,107)(H,98,108)(H,115,116)(H,117,118)(H2,119,120,121)(H2,122,123,124)/t66?,67?,68?,69?,70-,71-,72-,73-,74-,75-,81-,82-,83-,84-,85-,86-,87-,88-,89-,90-,91-,92-,95-,96-/m1/s1
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SMILES |
CCCCCCCCCCCC(O)CC(=O)NC4C(OC(COC3OC(COC2(CC(OC1(CC(O)C(O)C(O1)C(O)CO)C(O)=O)C(O)C(O2)C(O)CO)C(O)=O)C(OP(O)(O)=O)C(OC(=O)CC(O)CCCCCCCCCCC)C3(NC(=O)CC(CCCCCCCCCCC)OC(=O)CCCCCCCCCCC))C(O)C4(OC(=O)CC(O)CCCCCCCCCCC))OP(O)(O)=O
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External Links | |
KEGG-COMPOUND-ID |
C06251
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PUBCHEM-ID | 8490 |
View all entries for compound: Lauroyl-KDO2-lipid IV(A) |