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CHEBI:206803 - Viridomonic acid A

ChEBI IDCHEBI:206803
ChEBI NameViridomonic acid A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC34H50O9
Net Charge0
Average Mass602.765
Monoisotopic Mass602.34548
SMILESCOC(=O)/C(CCC=C(C)C)=C1/C2CC(=O)C3[C@@]4(C)CC[C@@H](O)[C@@H](C)C4[C@@H](OC(C)=O)[C@H](O)[C@]3(C)[C@@]2(C)C[C@@H]1OC(C)=O
InChIInChI=1S/C34H50O9/c1-17(2)11-10-12-21(31(40)41-9)26-22-15-24(38)29-32(6)14-13-23(37)18(3)27(32)28(43-20(5)36)30(39)34(29,8)33(22,7)16-25(26)42-19(4)35/h11,18,22-23,25,27-30,37,39H,10,12-16H2,1-9H3/b26-21-/t18-,22?,23-,25+,27?,28-,29?,30+,32+,33+,34-/m1/s1
InChIKeyFKXQYPQNVVVJNI-IUWKFDSPSA-N
Species of MetaboliteComponentSourceComments
Cladosporiumspecies (ncbitaxon:1707700) - DOI (10.1016/s0040-4039(01)94162-0)
ChEBI Ontology
Outgoing Relation(s)
Viridomonic acid A (CHEBI:206803) is a steroid ester (CHEBI:47880)
IUPAC Name 
methyl (2Z)-2-[(3R,4S,6R,7R,8S,10S,14S,16S)-6,16-diacetyloxy-3,7-dihydroxy-4,8,10,14-tetramethyl-11-oxo-1,2,3,4,5,6,7,9,12,13,15,16-dodecahydrocyclopenta[a]phenanthren-17-ylidene]-6-methylhept-5-enoate
Manual XrefsDatabases
78445241ChemSpider