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CHEBI:201208 - Salinisporamycin

Default Structure
ChEBI IDCHEBI:201208
ChEBI NameSalinisporamycin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC33H43NO9
Net Charge0
Average Mass597.705
Monoisotopic Mass597.29378
SMILESC/C(=C/C=C/[C@H](C)[C@H](O)[C@@H](C)[C@H](O)[C@H](C)[C@@H]1O[C@@]2(C)CC[C@H](O2)[C@H]1C)C(=O)NC1=CC(=O)c2cc(O)c(C)c(O)c2C1=O
InChIInChI=1S/C33H43NO9/c1-15(27(37)19(5)28(38)20(6)31-18(4)25-11-12-33(7,42-25)43-31)9-8-10-16(2)32(41)34-22-14-24(36)21-13-23(35)17(3)29(39)26(21)30(22)40/h8-10,13-15,18-20,25,27-28,31,35,37-39H,11-12H2,1-7H3,(H,34,41)/b9-8+,16-10-/t15-,18+,19+,20-,25-,27-,28-,31+,33-/m0/s1
InChIKeyRRHNEUNNHGSOGZ-BLQRUWSHSA-N
Species of MetaboliteComponentSourceComments
Salinispora arenicola (ncbitaxon:168697) - PubMed (19662086)
ChEBI Ontology
Outgoing Relation(s)
Salinisporamycin (CHEBI:201208) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(2Z,4E,6S,7S,8R,9S,10S)-N-(6,8-dihydroxy-7-methyl-1,4-dioxonaphthalen-2-yl)-10-[(1S,3S,4R,5S)-1,4-dimethyl-2,8-dioxabicyclo[3.2.1]octan-3-yl]-7,9-dihydroxy-2,6,8-trimethylundeca-2,4-dienamide
Manual XrefsDatabases
78436741ChemSpider