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CHEBI:227931 - Rhizovarin A

ChEBI IDCHEBI:227931
ChEBI NameRhizovarin A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC37H44ClNO7
Net Charge0
Average Mass650.212
Monoisotopic Mass649.28063
SMILESC=C(C)[C@H]1OC2CC[C@@]3(C)C(CC[C@]4(O)O[C@@H]5OC(C)(C)[C@H]6C[C@@H]7C(=C)Cc8c(Cl)cc9nc(c5c9c8[C@@]76O)[C@]34C)[C@]23O[C@@H]3[C@H]1O
InChIInChI=1S/C37H44ClNO7/c1-15(2)28-27(40)30-37(44-30)21-8-11-35(41)34(7,33(21,6)10-9-23(37)43-28)29-25-24-20(39-29)14-19(38)17-12-16(3)18-13-22(36(18,42)26(17)24)32(4,5)45-31(25)46-35/h14,18,21-23,27-28,30-31,39-42H,1,3,8-13H2,2,4-7H3/t18-,21?,22-,23?,27+,28-,30-,31+,33+,34-,35+,36-,37+/m1/s1
InChIKeyOKHUUWADPPXCOJ-OLVPRZBHSA-N
Species of MetaboliteComponentSourceComments
Mucor (ncbitaxon:4830) - PubMed (27462726)
ChEBI Ontology
Outgoing Relation(s)
Rhizovarin A (CHEBI:227931) is a organic heterotricyclic compound (CHEBI:26979)
Rhizovarin A (CHEBI:227931) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(1S,3S,7S,9R,10S,11R,16S,17S,26R,28S,29R)-22-chloro-16,17,34,34-tetramethyl-25-methylidene-11-prop-1-en-2-yl-2,8,12,33-tetraoxa-19-azadecacyclo[26.4.2.03,17.06,16.07,9.07,13.018,32.020,31.023,30.026,29]tetratriaconta-18(32),20,22,30-tetraene-3,10,29-triol
Manual XrefsDatabases
78441610ChemSpider