CHEBI:215556 - Onoceranoxide

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Onoceranoxide
ChEBI ID CHEBI:215556
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C30H52O
Net Charge 0
Average Mass 428.745
Monoisotopic Mass 428.40182
InChI InChI=1S/C30H52O/c1-25(2)15-9-17-27(5)21(25)13-19-29(7)23(27)11-12-24-28(6)18-10-16-26(3,4)22(28)14-20-30(24,8)31-29/h21-24H,9-20H2,1-8H3/t21-,22-,23+,24+,27-,28-,29+,30+/m0/s1
InChIKey WKJQOTFJIQYADY-QPYQYMOUSA-N
SMILES O1[C@]2([C@@H]([C@@]3([C@H](C(CCC3)(C)C)CC2)C)CC[C@H]4[C@]1(CC[C@@H]5[C@@]4(CCCC5(C)C)C)C)C
Metabolite of Species Details
Bacillus (NCBI:txid1386) See: PubMed
ChEBI Ontology
Outgoing Onoceranoxide (CHEBI:215556) is a triterpenoid (CHEBI:36615)
IUPAC Name
(1R,3R,6S,11S,12R,15R,16S,21S)-1,3,7,7,11,16,20,20-octamethyl-2-oxapentacyclo[13.8.0.03,12.06,11.016,21]tricosane
Manual Xref Database
10283594 ChemSpider
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