[(1R,2R,3S,7R,9R,10R,12S)-3,10-dihydroxy-1,5-dimethyl-4-oxospiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-2-yl]methyl acetate

License

No License Provided

Export

DCAT-AP(rdf/xml) DCAT-AP(ttl) DCAT-AP(jsonld) DCAT-AP-PLUS(xml) DCAT-AP-PLUS(tll) DCAT-AP-PLUS(jsonld)

Schema.Org(rdf/xml) Schema.Org(xml) Schema.Org(ttl) Schema.Org(jsonld)

Molecule

[(1R,2R,3S,7R,9R,10R,12S)-3,10-dihydroxy-1,5-dimethyl-4-oxospiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-2-yl]methyl acetate

Chemical Information

10 Related Dataset(s) ⌄

15-Acetyldeoxynivalenol; LC-APCI-ITFT; MS2; CE: 10; R=17500; [M+H]+

15-Acetyldeoxynivalenol; LC-APCI-ITFT; MS2; CE: 10; R=17500; [M-H2O+H]+

15-Acetyldeoxynivalenol; LC-APCI-ITFT; MS2; CE: 20; R=17500; [M+H]+

15-Acetyldeoxynivalenol; LC-APCI-ITFT; MS2; CE: 20; R=17500; [M-H2O+H]+

15-Acetyldeoxynivalenol; LC-APCI-ITFT; MS2; CE: 30; R=17500; [M+H]+

15-Acetyldeoxynivalenol; LC-APCI-ITFT; MS2; CE: 30; R=17500; [M-H2O+H]+

15-Acetyldeoxynivalenol; LC-APCI-ITFT; MS2; CE: 40; R=17500; [M+H]+

15-Acetyldeoxynivalenol; LC-APCI-ITFT; MS2; CE: 40; R=17500; [M-H2O+H]+

15-Acetyldeoxynivalenol; LC-APCI-ITFT; MS2; CE: 55; R=17500; [M+H]+

15-Acetyldeoxynivalenol; LC-APCI-ITFT; MS2; CE: 55; R=17500; [M-H2O+H]+

Metadata Information

Field	Value
NFDI4Chem Molecule ID	nfdi4chem-mol98551
Source
Alternate Name

Field	Value
No additional information available for this Dataset.

Data-Source Molecule ID	Data-Source
CHEMBL468823	ChEMBL
ZULWAG	CCDC
J275.533E	Nikkaji
0430X4R3Z1	FDA SRS
HY-N6683	MedChemExpress
146194	ChEBI
MTBLC146194	Metabolights
CB5435409	ChemicalBook
10382483	PubChem
15397638	PubChem: Thomson Pharma
LMPR0103180003	LipidMaps
60059623	NMRShiftDB
26751647	eMolecules
36755624	eMolecules
ZINC000033650232	ZINC
The data in this table is sourced from UniChem at EBI.