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CHEBI:221605 - Albofungin A

ChEBI IDCHEBI:221605
ChEBI NameAlbofungin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H22N2O9
Net Charge0
Average Mass506.467
Monoisotopic Mass506.13253
SMILESCc1cc2cc3c(c(O)c2c(=O)n1N)-c1c2c(c4oc5c(c(=O)c4c1O)[C@@H](O)CC[C@H]5O)OCO[C@@H]2C3
InChIInChI=1S/C26H22N2O9/c1-8-4-9-5-10-6-13-17-18(14(10)20(31)15(9)26(34)28(8)27)22(33)19-21(32)16-11(29)2-3-12(30)23(16)37-25(19)24(17)36-7-35-13/h4-5,11-13,29-31,33H,2-3,6-7,27H2,1H3/t11-,12+,13+/m0/s1
InChIKeyKALFNUGKWWYZGJ-YNEHKIRRSA-N
Species of MetaboliteComponentSourceComments
Streptomyces chrestomyceticus (ncbitaxon:68185) - PubMed (33633715)
ChEBI Ontology
Outgoing Relation(s)
Albofungin A (CHEBI:221605) is a diterpenoid (CHEBI:23849)
IUPAC Name 
(13R,21R,24S)-6-amino-3,21,24,28-tetrahydroxy-7-methyl-14,16,19-trioxa-6-azaheptacyclo[15.11.1.02,11.04,9.013,29.018,27.020,25]nonacosa-1(29),2(11),3,7,9,17,20(25),27-octaene-5,26-dione