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CHEBI:218823 - (+)-viridicatumtoxin B

ChEBI IDCHEBI:218823
ChEBI Name(+)-viridicatumtoxin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H29NO10
Net Charge0
Average Mass563.559
Monoisotopic Mass563.17915
SMILESCOc1cc(O)c2c(O)c3c(c4c2c1[C@]1(C4)C(C)=CCCC1(C)C)C(=O)[C@@]1(O)CC(=O)C(C(N)=O)=C(O)[C@@]1(O)C3=O
InChIInChI=1S/C30H29NO10/c1-11-6-5-7-27(2,3)28(11)9-12-16-18(13(32)8-15(41-4)21(16)28)22(34)20-17(12)23(35)29(39)10-14(33)19(26(31)38)24(36)30(29,40)25(20)37/h6,8,32,34,36,39-40H,5,7,9-10H2,1-4H3,(H2,31,38)/t28-,29-,30+/m0/s1
InChIKeyWUFPHUQCGWRGKE-OIFRRMEBSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (19168978)
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
(+)-viridicatumtoxin B (CHEBI:218823) is a tetracyclines (CHEBI:26895)
IUPAC Name 
(4'R,6S,9'S)-4',8',9',12',14'-pentahydroxy-16'-methoxy-1,5,5-trimethyl-3',6',10'-trioxospiro[cyclohexene-6,18'-pentacyclo[11.6.1.02,11.04,9.017,20]icosa-1(20),2(11),7,12,14,16-hexaene]-7'-carboxamide
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78441369ChemSpider