Racemomycin E

AlkaPlorer ID: AK031781

Synonym: 'Racemomycin E', 'A 53930C', 'Streptothricin B'

IUPAC Name: [(2R,3R,4S,5R,6R)-5-[[(3S)-3-amino-6-[[(3S)-3-amino-6-[[(3S)-3-amino-6-[[(3S)-3-amino-6-[[(3S)-3,6-diaminohexanoyl]amino]hexanoyl]amino]hexanoyl]amino]hexanoyl]amino]hexanoyl]amino]-4-hydroxy-2-(hydroxymethyl)-6-[[(7R)-7-hydroxy-4-oxo-1,3a,5,6,7,7a-hexahydroimidazo[4,5-c]pyridin-2-yl]amino]oxan-3-yl] carbamate

Structure

SMILES: N=C(O)O[C@@H]1[C@@H](O)[C@@H](N=C(O)C[C@@H](N)CCCN=C(O)C[C@@H](N)CCCN=C(O)C[C@@H](N)CCCN=C(O)C[C@@H](N)CCCN=C(O)C[C@@H](N)CCCN)[C@H](NC2=NC3C(N2)C(O)=NC[C@H]3O)O[C@@H]1CO

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InChI: InChI=1S/C43H82N16O12/c44-11-1-6-23(45)16-30(62)51-12-2-7-24(46)17-31(63)52-13-3-8-25(47)18-32(64)53-14-4-9-26(48)19-33(65)54-15-5-10-27(49)20-34(66)56-37-38(67)39(71-42(50)69)29(22-60)70-41(37)59-43-57-35-28(61)21-55-40(68)36(35)58-43/h23-29,35-39,41,60-61,67H,1-22,44-49H2,(H2,50,69)(H,51,62)(H,52,63)(H,53,64)(H,54,65)(H,55,68)(H,56,66)(H2,57,58,59)/t23-,24-,25-,26-,27-,28+,29+,35?,36?,37+,38-,39-,41+/m0/s1

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InChIKey: SFBVRPSSMVXTDR-BNXXPTCYSA-N

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Properties Information

Molecule Weight: 1015.2289999999996

TPSA: 511.31000000000006

MolLogP: -1.8427300000000115

Number of H-Donors: 19

Number of H-Acceptors: 21

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information