CHEBI:200630 - Tetrodecamycin

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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 Tetrodecamycin
ChEBI ID CHEBI:200630
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C18H22O6
Net Charge 0
Average Mass 334.368
Monoisotopic Mass 334.14164
InChI InChI=1S/C18H22O6/c1-8-12-15(20)18(22)7-5-4-6-10(18)17(8,3)14(19)11-13(24-12)9(2)23-16(11)21/h8,10,12,15,20,22H,2,4-7H2,1,3H3/t8-,10+,12+,15-,17-,18+/m1/s1
InChIKey VSUPSZGXABDKGD-XOAGZRPRSA-N
SMILES O=C1C=2C(=O)OC(C2O[C@H]3[C@H]([C@@]1([C@H]4[C@](O)([C@@H]3O)CCCC4)C)C)=C
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: PubMed
ChEBI Ontology
Outgoing Tetrodecamycin (CHEBI:200630) is a butenolide (CHEBI:50523)
IUPAC Name
(1R,2S,7S,8R,9S,17S)-7,8-dihydroxy-1,17-dimethyl-12-methylidene-10,13-dioxatetracyclo[7.7.1.02,7.011,15]heptadec-11(15)-ene-14,16-dione
Manual Xref Database
8849839 ChemSpider
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