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CHEBI:225846 - Kendomycin C

ChEBI IDCHEBI:225846
ChEBI NameKendomycin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H44O5S
Net Charge0
Average Mass516.744
Monoisotopic Mass516.29095
SMILESCSC1=C2C3=CC(=O)C(O)=C2[C@@H]2O[C@H](CC[C@H](C)/C=C(\C)C[C@@H](C)C[C@H](C)[C@]1(O)O3)[C@H](C)[C@H](C)[C@H]2C
InChIInChI=1S/C30H44O5S/c1-15-9-10-23-20(6)19(5)21(7)28(34-23)26-25-24(14-22(31)27(26)32)35-30(33,29(25)36-8)18(4)13-17(3)12-16(2)11-15/h11,14-15,17-21,23,28,32-33H,9-10,12-13H2,1-8H3/b16-11+/t15-,17+,18-,19-,20+,21+,23+,28+,30-/m0/s1
InChIKeyHFTCCQWNMHPCBI-DFLBTMGNSA-N
Species of MetaboliteComponentSourceComments
Micromonospora (ncbitaxon:1873) - PubMed (31765156)
ChEBI Ontology
Outgoing Relation(s)
Kendomycin C (CHEBI:225846) is a benzofurans (CHEBI:35259)
IUPAC Name 
(1R,9S,10S,12S,14E,16S,19R,20R,21S,22R)-3,9-dihydroxy-10,12,14,16,20,21,22-heptamethyl-8-methylsulanyl-23,24-dioxatetracyclo[17.3.1.16,9.02,7]tetracosa-2,5,7,14-tetraen-4-one