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CHEBI:220968 - Forazoline A

ChEBI IDCHEBI:220968
ChEBI NameForazoline A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC43H69ClN4O10S2
Net Charge0
Average Mass901.630
Monoisotopic Mass900.41436
SMILESCO[C@H]1S(=O)C2=CC(=O)[C@](C)(O[C@H]3CC[C@H](N(C)C)[C@@H](C)O3)[C@@H](O)CCC(C)=C[C@@H]3[C@@H](C)[C@](C)(Cl)[C@@H](C[C@H]3O[C@H]3CC[C@H](N(C)C)[C@@H](C)O3)OC(=O)[C@@H]3CSC(=N3)[C@]1(C)N2
InChIInChI=1S/C43H69ClN4O10S2/c1-23-13-16-32(49)43(7,58-37-18-15-30(48(10)11)26(4)55-37)33(50)21-35-46-42(6,40(53-12)60(35)52)39-45-28(22-59-39)38(51)57-34-20-31(27(19-23)24(2)41(34,5)44)56-36-17-14-29(47(8)9)25(3)54-36/h19,21,24-32,34,36-37,40,46,49H,13-18,20,22H2,1-12H3/t24-,25-,26-,27-,28+,29+,30+,31-,32+,34-,36+,37+,40+,41+,42+,43-,60?/m1/s1
InChIKeyLCXAZCVSKYUTII-CXFLASQRSA-N
Species of MetaboliteComponentSourceComments
Actinomadura (ncbitaxon:1988) - PubMed (25197007)
ChEBI Ontology
Outgoing Relation(s)
Forazoline A (CHEBI:220968) is a aminoglycoside (CHEBI:47779)
IUPAC Name 
(1R,4R,8S,9S,14R,15S,20R,21R,22S,24R)-22-chloro-14,24-bis[[(2S,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy]-15-hydroxy-9-methoxy-8,14,18,21,22-pentamethyl-10-oxo-2-oxa-6,10lambda4-dithia-25,26-diazatetracyclo[18.2.2.14,7.18,11]hexacosa-7(26),11,18-triene-3,13-dione