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08. Chemical Category
08. Chemical Category
precorrin-3B [CHEBI:27711] (1)
precorrin-3B [CHEBI:27711] (1)
precorrin-3B [CHEBI:27711] (1)
precorrin-3B [CHEBI:27711] (1)
precorrin-3B [CHEBI:27711] (1)
precorrin-3B [CHEBI:27711] (1)
precorrin-3B [CHEBI:27711] (1)
precorrin-3B [CHEBI:27711] (1)
precorrin-3B [CHEBI:27711] (1)
precorrin-3B [CHEBI:27711] (1)
precorrin-3B [CHEBI:27711] (1)
precorrin-3B [CHEBI:27711] (1)
precorrin-3B [CHEBI:27711] (1)
precorrin-3B [CHEBI:27711] (1)
precorrin-3B [CHEBI:27711] (1)
precorrin-3B [CHEBI:27711] (1)
precorrin-3B [CHEBI:27711] (1)
precorrin-3B [CHEBI:27711] (1)
precorrin-3B [CHEBI:27711] (1)
precorrin-3B [CHEBI:27711] (1)
precorrin-3B [CHEBI:27711] (1)
precorrin-3B [CHEBI:27711] (1)
precorrin-3B [CHEBI:27711] (1)
ChEBI Compound Accession Identifier :
[CHEBI:27711]
ChEBI Compound Description :
The intermediate in the biosynthesis of vitamin B12 from uroporphyrinogen III in which three methyl groups have been introduced at positions 2, 7 and 20 of the tetrapyrrole framework and in which the carboxymethyl group at position 2 has been oxidised to form a lactone ring.
ChEBI Compound Identification Number :
27711
ChEBI InChI Value :
InChI=1S/C43H50N4O17/c1-40(17-37(60)61)23(6-10-33(52)53)28-15-27-21(12-35(56)57)19(4-8-31(48)49)25(44-27)14-26-20(5-9-32(50)51)22(13-36(58)59)39(46-26)42(3,63)43-41(2,18-38(62)64-43)24(7-11-34(54)55)29(47-43)16-30(40)45-28/h15-16,23-24,44,46-47,63H,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)/b28-15-,29-16-/t23-,24-,40+,41+,42+,43-/m1/s1
ChEBI InChIKey Value :
KJHZYYJBHKAUHS-NXWQJPGNSA-N
ChEBI Compound Name :
precorrin-3B
ChEBI SMILES Value :
C[C@]1(CC(O)=O)[C@H](CCC(O)=O)C2=C/c3[nH]c(Cc4[nH]c(c(CC(O)=O)c4CCC(O)=O)[C@](C)(O)[C@@]45N/C(=C\C1=N\2)[C@@H](CCC(O)=O)[C@]4(C)CC(=O)O5)c(CCC(O)=O)c3CC(O)=O
ChEBI Substance ID :
81058764
ChEBI URL :
ChEBI:27711
ChemSpider ID :
4444433
Ontomatica Chemical Accession Key (OnChAKey) :
KJHZYYJBHKAUHS_NXWQJPGNSA_N_000_000000
PubChem Compound ID :
5280929