| Compound-ID | 8131 |
| Common Name | Precorrin 3A |
| InChI |
InChI=1S/C43H50N4O16/c1-19-40-23(13-37(58)59)21(5-9-33(50)51)27(46-40)14-26-20(4-8-32(48)49)22(12-36(56)57)28(44-26)15-29-24(6-10-34(52)53)42(2,17-38(60)61)31(45-29)16-30-25(7-11-35(54)55)43(3,18-39(62)63)41(19)47-30/h15-16,24-25,44,46-47H,4-14,17-18H2,1-3H3,(H,48,49)(H,50,51)(H,52,53)(H,54,55)(H,56,57)(H,58,59)(H,60,61)(H,62,63)/b29-15-,30-16-,41-19-/t24-,25-,42+,43+/m1/s1
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| SMILES |
CC=1c5nc(Cc4nc(C=C3N=C(C=C2NC=1C(C)(CC(O)=O)C2(CCC(O)=O))C(C)(CC(O)=O)C3(CCC(O)=O))c(CC(O)=O)c4(CCC(O)=O))c(CCC(O)=O)c5(CC(O)=O)
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| External Links | |
| KEGG-COMPOUND-ID |
C05772
|
| PUBCHEM-ID | 8067 |
| ChEBI-ID |
28307
|
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View all entries for compound: Precorrin 3A |