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CHEBI:63665 - 7β-hydroxytaxusin

ChEBI IDCHEBI:63665
ChEBI Name7β-hydroxytaxusin
Stars
ASCII Name7beta-hydroxytaxusin
DefinitionA taxane diterpenoid that is taxusin in which the hydrogen at the 7β position is replaced by a hydroxy group.
Last Modified1 April 2022
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC28H40O9
Net Charge0
Average Mass520.619
Monoisotopic Mass520.26723
SMILES[H][C@]12C[C@]([H])(OC(C)=O)C(C)=C([C@@H](OC(C)=O)[C@H](OC(C)=O)[C@]3(C)[C@@H](O)C[C@H](OC(C)=O)C(=C)[C@@]3([H])C1)C2(C)C
InChIInChI=1S/C28H40O9/c1-13-20-10-19-11-21(34-15(3)29)14(2)24(27(19,7)8)25(36-17(5)31)26(37-18(6)32)28(20,9)23(33)12-22(13)35-16(4)30/h19-23,25-26,33H,1,10-12H2,2-9H3/t19-,20-,21+,22+,23+,25-,26+,28+/m1/s1
InChIKeyCNURLWAZNDLNMK-CNZAUHOSSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
7β-hydroxytaxusin (CHEBI:63665) has functional parent taxusin (CHEBI:63664)
7β-hydroxytaxusin (CHEBI:63665) has role metabolite (CHEBI:25212)
7β-hydroxytaxusin (CHEBI:63665) is a acetate ester (CHEBI:47622)
7β-hydroxytaxusin (CHEBI:63665) is a carbotricyclic compound (CHEBI:38032)
7β-hydroxytaxusin (CHEBI:63665) is a secondary alcohol (CHEBI:35681)
7β-hydroxytaxusin (CHEBI:63665) is a taxane diterpenoid (CHEBI:50367)
IUPAC Name 
(5α,7β,9α,10β,13α)-7-hydroxytaxa-4(20),11-diene-5,9,10,13-tetrayl tetraacetate
UniProt Name  Source
7β-hydroxytaxusinUniProt
Citations