EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:227472 - Marformycin F

ChEBI IDCHEBI:227472
ChEBI NameMarformycin F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC42H66N8O10
Net Charge0
Average Mass843.036
Monoisotopic Mass842.49019
SMILESCOc1ccc(C[C@H]2NC(=O)[C@@H](NC(=O)[C@@H](NC=O)C(C)C)[C@@H](C)OC(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@@H]3CCCNN3C(=O)[C@@H](C(C)C)NC2=O)cc1
InChIInChI=1S/C42H66N8O10/c1-22(2)19-30-40(56)49(10)35(25(7)8)42(58)60-26(9)34(48-38(54)32(23(3)4)43-21-51)39(55)45-29(20-27-14-16-28(59-11)17-15-27)36(52)47-33(24(5)6)41(57)50-31(37(53)46-30)13-12-18-44-50/h14-17,21-26,29-35,44H,12-13,18-20H2,1-11H3,(H,43,51)(H,45,55)(H,46,53)(H,47,52)(H,48,54)/t26-,29-,30+,31+,32+,33-,34+,35+/m1/s1
InChIKeyYHBUARZUCVRARP-RTQHVXCCSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - DOI (10.1016/j.tet.2014.02.007)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Marformycin F (CHEBI:227472) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name 
(2S)-2-ormamido-N-[(3R,6R,9S,10R,13S,16S,19S)-6-[(4-methoxyphenyl)methyl]-10,14-dimethyl-16-(2-methylpropyl)-2,5,8,12,15,18-hexaoxo-3,13-di(propan-2-yl)-11-oxa-1,4,7,14,17,23-hexazabicyclo[17.4.0]tricosan-9-yl]-3-methylbutanamide
Manual XrefsDatabases
34981688ChemSpider