Amamistatin A; Demethoxy

AlkaPlorer ID: AK284092

Synonym: Amamistatin B

IUPAC Name: [1-[(1-hydroxy-2-oxoazepan-3-yl)amino]-2,2-dimethyl-1-oxodecan-3-yl] 6-[formyl(hydroxy)amino]-2-[[2-(2-hydroxyphenyl)-5-methyl-1,3-oxazole-4-carbonyl]amino]hexanoate

Structure

SMILES: CCCCCCCC(OC(=O)C(CCCCN(O)C=O)NC(=O)C1=C(C)OC(C2=CC=CC=C2O)=N1)C(C)(C)C(=O)NC1CCCCN(O)C1=O

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InChI: InChI=1S/C36H53N5O10/c1-5-6-7-8-9-20-29(36(3,4)35(47)38-26-17-13-15-22-41(49)33(26)45)51-34(46)27(18-12-14-21-40(48)23-42)37-31(44)30-24(2)50-32(39-30)25-16-10-11-19-28(25)43/h10-11,16,19,23,26-27,29,43,48-49H,5-9,12-15,17-18,20-22H2,1-4H3,(H,37,44)(H,38,47)

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InChIKey: ZCNZVZVNVGHAHB-UHFFFAOYSA-N

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Reference

PubChem CID: 163005942

CAS: 225505-77-1

COCONUT: CNP0280264.2

Source

Species Genus Family Order Class Phylum Kingdom Domain
Nocardia asteroides Nocardia Nocardiaceae Mycobacteriales Actinomycetes Actinomycetota None Bacteria

Properties Information

Molecule Weight: 715.8449999999998

TPSA: 211.84

MolLogP: 4.656920000000004

Number of H-Donors: 5

Number of H-Acceptors: 11

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information