CHEBI:222221 - Marinoterpin A

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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 Marinoterpin A
ChEBI ID CHEBI:222221
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C35H45NO4
Net Charge 0
Average Mass 543.748
Monoisotopic Mass 543.33486
InChI InChI=1S/C35H45NO4/c1-24(2)16-31-19-28(22-39-31)12-8-10-25(3)17-32-20-29(23-40-32)13-9-11-26(4)18-35(37)33-21-30-14-6-7-15-34(30)36(38)27(33)5/h6-7,12-17,21,26,31-32H,8-11,18-20,22-23H2,1-5H3/b25-17+,28-12-,29-13-/t26?,31-,32-/m0/s1
InChIKey OZKCIHASMKWRDZ-GNTUBIQZSA-N
SMILES O=C(C=1C(=[N+]([O-])C2=CC=CC=C2C1)C)CC(CC/C=C/3\CO[C@H](C3)/C=C(/CC/C=C/4\CO[C@H](C4)C=C(C)C)\C)C
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: PubMed
ChEBI Ontology
Outgoing Marinoterpin A (CHEBI:222221) is a sesterterpenoid (CHEBI:26660)