CHEBI:227673 - Etamycin VII

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Etamycin VII
ChEBI ID CHEBI:227673
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C43H60N8O11
Net Charge 0
Average Mass 864.998
Monoisotopic Mass 864.43815
InChI InChI=1S/C43H60N8O11/c1-10-24(4)33-42(60)51-21-28(52)19-29(51)41(59)48(7)22-32(55)50(9)36(25(5)23(2)3)40(58)45-20-31(54)49(8)37(27-15-12-11-13-16-27)43(61)62-26(6)34(38(56)46-33)47-39(57)35-30(53)17-14-18-44-35/h11-18,23-26,28-29,33-34,36-37,52-53H,10,19-22H2,1-9H3,(H,45,58)(H,46,56)(H,47,57)/t24?,25?,26?,28-,29?,33?,34?,36?,37?/m1/s1
InChIKey SVQVWNBXETXIRV-DXRMQHEXSA-N
SMILES O=C1OC(C(NC(=O)C2=NC=CC=C2O)C(=O)NC(C(=O)N3C(C(=O)N(C)CC(N(C(C(NCC(N(C1C4=CC=CC=C4)C)=O)=O)C(C(C)C)C)C)=O)C[C@H](C3)O)C(CC)C)C
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: PubMed
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Etamycin VII (CHEBI:227673) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name
N-[(24R)-3-butan-2-yl-24-hydroxy-7,11,17,20-tetramethyl-16-(3-methylbutan-2-yl)-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-hydroxypyridine-2-carboxamide
Manual Xref Database
78445424 ChemSpider
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