Compound-ID | 8627 |
Common Name | Precorrin 5 |
InChI |
InChI=1S/C45H54N4O17/c1-21(50)45-40-26(15-37(61)62)41(2,13-12-35(57)58)30(47-40)16-27-22(6-9-32(51)52)25(14-36(59)60)44(5,48-27)18-29-23(7-10-33(53)54)42(3,19-38(63)64)31(46-29)17-28(49-45)24(8-11-34(55)56)43(45,4)20-39(65)66/h17,24,49H,6-16,18-20H2,1-5H3,(H,51,52)(H,53,54)(H,55,56)(H,57,58)(H,59,60)(H,61,62)(H,63,64)(H,65,66)/b28-17-/t24-,41-,42+,43+,44+,45?/m1/s1
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SMILES |
CC(=O)C25(NC(=CC4=NC(CC3(C)(N=C(CC1=NC2(=C(CC(O)=O)C1(C)(CCC(O)=O)))C(CCC(O)=O)=C3(CC(O)=O)))=C(CCC(O)=O)C4(C)(CC(O)=O))C(CCC(O)=O)C5(C)(CC(O)=O))
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External Links | |
KEGG-COMPOUND-ID |
C06416
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PUBCHEM-ID | 8651 |
ChEBI-ID |
27630
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View all entries for compound: Precorrin 5 |