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Etamycin A

View entire compound with spectra: 3 MS (GC)

Etamycin A
SpectraBase Compound ID 75l7Z7ZAPxZ
InChI InChI=1S/C44H62N8O11/c1-23(2)19-30-42(60)52-21-29(53)20-31(52)43(61)49(8)22-33(55)50(9)36(25(5)24(3)4)40(58)46-26(6)41(59)51(10)37(28-15-12-11-13-16-28)44(62)63-27(7)34(38(56)47-30)48-39(57)35-32(54)17-14-18-45-35/h11-18,23-27,29-31,34,36-37,53-54H,19-22H2,1-10H3,(H,46,58)(H,47,56)(H,48,57)
InChIKey SATIISJKSAELDC-UHFFFAOYSA-N
Mol Weight 879.0 g/mol
Molecular Formula C44H62N8O11
Exact Mass 878.453805 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KeLaSpBHtU0
Name Etamycin A
CAS Registry Number 299-20-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C44H62N8O11
InChI InChI=1S/C44H62N8O11/c1-23(2)19-30-42(60)52-21-29(53)20-31(52)43(61)49(8)22-33(55)50(9)36(25(5)24(3)4)40(58)46-26(6)41(59)51(10)37(28-15-12-11-13-16-28)44(62)63-27(7)34(38(56)47-30)48-39(57)35-32(54)17-14-18-45-35/h11-18,23-27,29-31,34,36-37,53-54H,19-22H2,1-10H3,(H,46,58)(H,47,56)(H,48,57)
InChIKey SATIISJKSAELDC-UHFFFAOYSA-N
Molecular Weight 879.025 g/mol
SMILES N1C(C(N(C(C(OC(C(C(NC(C(N2CC(CC2C(N(CC(N(C(C1=O)C(C(C)C)C)C)=O)C)=O)O)=O)CC(C)C)=O)NC(c1c(cccn1)O)=O)C)=O)c1ccccc1)C)=O)C
SPLASH splash10-0076-9610000000-16624e1889e19eb25505
Source of Spectrum O-6-162-8
Synonyms 3-Hydroxy-N-[24-hydroxy-7,11,13,17,20-pentamethyl-16-(3-methylbutan-2-yl)-3-(2-methylpropyl)-2,5,9,12,15,18,21-heptaoxo-10-phenyl-8-oxa-1,4,11,14,17,20-hexazabicyclo[20.3.0]pentacosan-6-yl]-2-pyridinecarboxamide 3-Hydroxy-N-[24-hydroxy-7,11,13,17,20-pentamethyl-16-(3-methylbutan-2-yl)-3-(2-methylpropyl)-2,5,9,12,15,18,21-heptaoxo-10-phenyl-8-oxa-1,4,11,14,17,20-hexazabicyclo[20.3.0]pentacosan-6-yl]pyridine-2-carboxamide 3-Oxidanyl-N-[7,11,13,17,20-pentamethyl-16-(3-methylbutan-2-yl)-3-(2-methylpropyl)-24-oxidanyl-2,5,9,12,15,18,21-heptakis(oxidanylidene)-10-phenyl-8-oxa-1,4,11,14,17,20-hexazabicyclo[20.3.0]pentacosan-6-yl]pyridine-2-carboxamide Antibiotic K-179 Etamycin Glycine, N-[(3-hydroxy-2-pyridinyl)carbonyl]-L-threonyl-D-leucyl-4-allo-hydroxy-D-prolyl-N-methylglycyl-N,3,4-trimethyl-L-norvalyl-L-alanyl-N-methyl-L-2-phenyl-, .upsilon.-lactone Glycine, N-[N-[N-[N-[4-allo-hydroxy-1-[N-[N-[(3-hydroxy-2-pyridinyl)carbonyl]-L-threonyl]-D-leucyl]-D-prolyl]-N-methylglycyl]-N,3-dimethyl-L-leucyl]-L-alanyl]-N-methyl-L-2-phenyl-, .upsilon.-lactone N-[16-(1,2-dimethylpropyl)-24-hydroxy-3-isobutyl-2,5,9,12,15,18,21-heptaketo-7,11,13,17,20-pentamethyl-10-phenyl-8-oxa-1,4,11,14,17,20-hexazabicyclo[20.3.0]pentacosan-6-yl]-3-hydroxy-picolinamide N-[16-(1,2-dimethylpropyl)-24-hydroxy-3-isobutyl-7,11,13,17,20-pentamethyl-2,5,9,12,15,18,21-heptaoxo-10-phenyl-8-oxa-1,4,11,14,17,20-hexazabicyclo[20.3.0]pentacosan-6-yl]-3-hydroxy-pyridine-2-carboxamide N-[N-[N-[N-[4-Allo-hydroxy-1-[N-[N-[(3-hydroxy-2-pyridinyl)carbonyl]-L-threonyl]-D-leucyl]-D-prolyl]-N-methylglycyl]-N,3-dimethyl-L-leucyl]-L-alanyl]-N-methyl-L-2-phenylglycine .upsilon.-lactone Neoviridogrisein iv Viridogrisein Viridogrisein I Antibiotic F-1370A BRN 0078383
Wiley ID 66944