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CHEBI:218224 - (+)-variecolortin B

ChEBI IDCHEBI:218224
ChEBI Name(+)-variecolortin B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC36H33N3O7
Net Charge0
Average Mass619.674
Monoisotopic Mass619.23185
SMILESC=CC(C)(C)c1nc2ccccc2c1/C=C1\NC(=O)[C@@]2(CC[C@@]3(O)c4cc(OC)cc(O)c4C(=O)c4c(O)cc(C)c2c43)NC1=O
InChIInChI=1S/C36H33N3O7/c1-6-34(3,4)31-20(19-9-7-8-10-22(19)37-31)16-23-32(43)39-35(33(44)38-23)11-12-36(45)21-14-18(46-5)15-25(41)26(21)30(42)27-24(40)13-17(2)28(35)29(27)36/h6-10,13-16,37,40-41,45H,1,11-12H2,2-5H3,(H,38,44)(H,39,43)/b23-16-/t35-,36+/m0/s1
InChIKeyOEOHUHONOQKCPA-UPIWRQINSA-N
Species of MetaboliteComponentSourceComments
Eurotiumspecies SCSIO F452 (ncbitaxon:1246140) - PubMed (30011219)
Roles Classification
Biological Role:
xenobiotic  A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
ChEBI Ontology
Outgoing Relation(s)
(+)-variecolortin B (CHEBI:218224) is a phenanthrenes (CHEBI:25961)
IUPAC Name 
(3S,6'Z,11bR)-6,8,11b-trihydroxy-10-methoxy-4-methyl-6'-[[2-(2-methylbut-3-en-2-yl)-1H-indol-3-yl]methylidene]spiro[1,2-dihydrobenzo[a]phenalene-3,3'-piperazine]-2',5',7-trione
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