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CHEBI:206846 - Naphthablin C

ChEBI IDCHEBI:206846
ChEBI NameNaphthablin C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC29H34O9
Net Charge0
Average Mass526.582
Monoisotopic Mass526.22028
SMILESCC(C)C(=O)O[C@H]1C[C@H]2[C@@H](C[C@H]1C)C1=C(OC2(C)C)C(=O)c2c(cc(O)c3c2O[C@@H]2[C@@H](O)OC[C@]32C)C1=O
InChIInChI=1S/C29H34O9/c1-11(2)26(33)36-17-9-15-13(7-12(17)3)18-21(31)14-8-16(30)20-23(37-25-27(34)35-10-29(20,25)6)19(14)22(32)24(18)38-28(15,4)5/h8,11-13,15,17,25,27,30,34H,7,9-10H2,1-6H3/t12-,13-,15+,17+,25-,27+,29-/m1/s1
InChIKeyJSRBXSCKRHOJOA-MPUJPLSISA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (28128950)
ChEBI Ontology
Outgoing Relation(s)
Naphthablin C (CHEBI:206846) is a organic heterotricyclic compound (CHEBI:26979)
Naphthablin C (CHEBI:206846) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
[(4R,6R,7S,9S,17S,18S,21S)-18,23-dihydroxy-6,10,10,21-tetramethyl-2,13-dioxo-11,16,19-trioxahexacyclo[12.10.0.03,12.04,9.015,22.017,21]tetracosa-1(24),3(12),14,22-tetraen-7-yl] 2-methylpropanoate
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61708491ChemSpider