CHEBI:206955 - Reveromycin F

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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 Reveromycin F
ChEBI ID CHEBI:206955
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C37H54O11
Net Charge 0
Average Mass 674.828
Monoisotopic Mass 674.36661
InChI InChI=1S/C37H54O11/c1-6-7-8-20-36(31(15-11-26(3)24-34(43)44)46-35(45)18-17-33(41)42)22-23-37(48-36)21-19-28(5)30(47-37)14-10-25(2)9-13-29(38)27(4)12-16-32(39)40/h9-13,15-16,24,27-31,38H,6-8,14,17-23H2,1-5H3,(H,39,40)(H,41,42)(H,43,44)/b13-9+,15-11+,16-12+,25-10+,26-24+/t27-,28-,29-,30+,31-,36+,37-/m0/s1
InChIKey LERGBDZGLQLWCD-SFKKXSHQSA-N
SMILES O=C(O)/C=C(/C=C/[C@H](OC(=O)CCC(=O)O)[C@@]1(O[C@]2(O[C@@H]([C@@H](C)CC2)C/C=C(/C=C/[C@H](O)[C@H](/C=C/C(=O)O)C)\C)CC1)CCCCC)\C
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: PubMed
ChEBI Ontology
Outgoing Reveromycin F (CHEBI:206955) is a diterpene glycoside (CHEBI:71939)
IUPAC Name
(2E,4S,5S,6E,8E)-10-[(2R,5S,8S,9R)-2-[(1S,2E,4E)-5-carboxy-1-(3-carboxypropanoyloxy)-4-methylpenta-2,4-dienyl]-8-methyl-2-pentyl-1,10-dioxaspiro[4.5]decan-9-yl]-5-hydroxy-4,8-dimethyldeca-2,6,8-trienoic acid
Manual Xref Database
78439830 ChemSpider
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