Libertalide H (CHEBI:208534)

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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	Libertalide H

ChEBI ID	CHEBI:208534

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C16H24O5

Net Charge

Average Mass

296.363

Monoisotopic Mass

296.16237

InChI

InChI=1S/C16H24O5/c1-13(18)6-4-9-14(2)7-5-10(17)21-15(14,3)11-12(20-11)16(9,19)8-13/h9,11-12,18-19H,4-8H2,1-3H3/t9-,11+,12-,13-,14-,15-,16-/m1/s1

InChIKey

CBGRIGQKMAWNBD-HAAZRRINSA-N

SMILES

O=C1O[C@]2([C@]([C@@H]3[C@](O)(C[C@@](O)(C)CC3)[C@H]4[C@@H]2O4)(C)CC1)C

ChEBI Ontology
Outgoing	Libertalide H (CHEBI:208534) is a organic heterotricyclic compound (CHEBI:26979) Libertalide H (CHEBI:208534) is a organooxygen compound (CHEBI:36963)

IUPAC Name

(1R,2R,4S,5S,10R,11R,14R)-1,14-dihydroxy-5,10,14-trimethyl-3,6-dioxatetracyclo[9.4.0.02,4.05,10]pentadecan-7-one