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Compounds

COMPOUND NPA020587

STRUCTURE

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PROPERTIES

NPAID	NPA020587
CLUSTER ID	2157
NODE ID	1720
NAME	Esperamicin A1c
FORMULA	C59H80N4O22S4
MOLECULAR WEIGHT (Da)	1325.5630
ACCURATE MASS (Da)	1324.4147
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Actinomadura
ORIGIN SPECIES	verrucosospora ATCC 39334
InChIKey	LJQQFQHBKUKHIS-ALPNVQRDSA-N
InChI	InChI=1S/C59H80N4O22S4/c1-28(2)60-36-27-77-43(25-39(36)73-8)83-52-50(66)47(63-85-45-24-37(64)53(86-12)31(5)79-45)29(3)80-57(52)82-38-18-16-14-15-17-20-59(71)34(19-21-88-89-87-13)46(38)48(62-58(70)76-11)51(67)54(59)84-44-26-42(49(65)30(4)78-44)81-56(69)33-22-40(74-9)41(75-10)23-35(33)61-55(68)32(6)72-7/h14-15,19,22-23,28-31,36-39,42-45,47,49-50,52-54,57,60,63-66,71H,6,21,24-27H2,1-5,7-13H3,(H,61,68)(H,62,70)/b15-14-,34-19-/t29-,30-,31-,36-,37+,38?,39-,42-,43-,44-,45+,47-,49+,50+,52-,53-,54?,57+,59?/m0/s1
SMILES	C[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)OC2C#C/C=C\C#CC\3(C(C(=O)C(=C2/C3=C/CSSSC)NC(=O)OC)O[C@H]4C[C@@H]([C@@H]([C@@H](O4)C)O)OC(=O)C5=CC(=C(C=C5NC(=O)C(=C)OC)OC)OC)O)O[C@H]6C[C@@H]([C@H](CO6)NC(C)C)OC)O)NO[C@@H]7C[C@H]([C@H]([C@@H](O7)C)SC)O

ORIGINAL ISOLATION REFERENCE

CITATION	Lam KS; Veitch JA; Golik J; Rose WC; Doyle TW; Forenza S Production and Isolation of Two Novel Esperamicins in a Chemically Defined Medium Journal of Antibiotics 1995 48 (12) 1497-1501.
DOI	10.7164/antibiotics.48.1497	PMID	8557609

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Actinobacteria	LPSN	201174
Class	Actinobacteria	LPSN	-
Order	Streptosporangiales	LPSN	85012
Family	Thermomonosporaceae	LPSN	2012
Genus	Actinomadura	LPSN	1988

CLASSYFIRE

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DESCRIPTION	[[ getValue('description') ]]
KINGDOM	[[ getValue('kingdom') ]]
SUPER CLASS	[[ getValue('superclass') ]]
CLASS	[[ getValue('class') ]]
SUB CLASS	[[ getValue('subclass') ]]
MOLECULAR FRAMEWORK	[[ getValue('molecular_framework') ]]

NP CLASSIFIER

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SUPER CLASS	[[ getValue('superclass_results') ]]
CLASS	[[ getValue('class_results') ]]
PATHWAY	[[ getValue('pathway_results') ]]
IS GLYCOSIDE?	[[ getValue('isglycoside') ]]

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