CHEBI:138823 - Iriomoteolide 1a

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ChEBI Name Iriomoteolide 1a
ChEBI ID CHEBI:138823
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C29H46O7
Net Charge 0
Average Mass 506.672
Monoisotopic Mass 506.32435
InChI InChI=1S/C29H46O7/c1-18-14-24-11-8-12-25(31)22(5)20(3)16-27(32)35-26(15-21(4)23(6)30)19(2)10-9-13-28(7,33)29(34,17-18)36-24/h8-9,12-13,16,19,21-26,30-31,33-34H,1,10-11,14-15,17H2,2-7H3/b12-8+,13-9+,20-16-/t19-,21-,22+,23-,24-,25-,26+,28+,29-/m0/s1
InChIKey LZLQZSMXUGFMJF-OMEQKXGASA-N
SMILES C1(C[C@]2(O[C@@](C1)([C@@](C=CC[C@@H]([C@@H](C[C@@H]([C@H](C)O)C)OC(C=C([C@H]([C@H](C=CC2)O)C)C)=O)C)(O)C)O)[H])=C
ChEBI Ontology
Outgoing Iriomoteolide 1a (CHEBI:138823) is a macrolide (CHEBI:25106)
Synonym Source
Iriomoteolide-1a KEGG COMPOUND
Manual Xref Database
C20009 KEGG COMPOUND
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Last Modified
25 October 2017