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CHEBI:8880 - Robustadial A

ChEBI IDCHEBI:8880
ChEBI NameRobustadial A
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC23H30O5
Net Charge0
Average Mass386.488
Monoisotopic Mass386.20932
SMILESCC(C)C[C@H]1C[C@@]2(CC[C@H]3C[C@@H]2C3(C)C)Oc2c(C=O)c(O)c(C=O)c(O)c21
InChIInChI=1S/C23H30O5/c1-12(2)7-13-9-23(6-5-14-8-17(23)22(14,3)4)28-21-16(11-25)19(26)15(10-24)20(27)18(13)21/h10-14,17,26-27H,5-9H2,1-4H3/t13-,14-,17+,23+/m0/s1
InChIKeySULUCYRQUAHFJK-MJDLOBTFSA-N
ChEBI Ontology
Outgoing Relation(s)
Robustadial A (CHEBI:8880) is a monoterpenoid (CHEBI:25409)
Synonym  Source
Robustadial AKEGG COMPOUND
Manual XrefsDatabases
C09966KEGG COMPOUND
C00003015KNApSAcK
Registry NumbersSources
CAS:8813-99-8KEGG COMPOUND
CAS:88130-99-8KEGG COMPOUND