Streptothricin; Streptothricin C, 4'-Decarbamoyl, 6'-carbamoyl

AlkaPlorer ID: AK314511

Synonym: Lavendothricin C, A 53930A, Antibiotic A 53930A, Isostreptothricin C

IUPAC Name: [5-[[3-amino-6-[[3-amino-6-[[3-amino-6-(3,6-diaminohexanoylamino)hexanoyl]amino]hexanoyl]amino]hexanoyl]amino]-3,4-dihydroxy-6-[(7-hydroxy-4-oxo-1,3a,5,6,7,7a-hexahydroimidazo[4,5-c]pyridin-2-yl)amino]oxan-2-yl]methyl carbamate

Structure

SMILES: NCCCC(N)CC(=O)NCCCC(N)CC(=O)NCCCC(N)CC(=O)NCCCC(N)CC(=O)NC1C(NC2=NC3C(=O)NCC(O)C3N2)OC(COC(N)=O)C(O)C1O

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InChI: InChI=1S/C37H70N14O11/c38-9-1-5-19(39)13-25(53)44-10-2-6-20(40)14-26(54)45-11-3-7-21(41)15-27(55)46-12-4-8-22(42)16-28(56)48-31-33(58)32(57)24(18-61-36(43)60)62-35(31)51-37-49-29-23(52)17-47-34(59)30(29)50-37/h19-24,29-33,35,52,57-58H,1-18,38-42H2,(H2,43,60)(H,44,53)(H,45,54)(H,46,55)(H,47,59)(H,48,56)(H2,49,50,51)

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InChIKey: JFQUFGDPMVGHMW-UHFFFAOYSA-N

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Reference

PubChem CID: 78301676

CAS: 142410-79-3

COCONUT: CNP0192022.7

Properties Information

Molecule Weight: 887.0540000000003

TPSA: 434.26

MolLogP: -6.912400000000022

Number of H-Donors: 16

Number of H-Acceptors: 19

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information