CHEBI:63665 - 7β-hydroxytaxusin

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ChEBI Name 7β-hydroxytaxusin
ChEBI ID CHEBI:63665
ChEBI ASCII Name 7beta-hydroxytaxusin
Definition A taxane diterpenoid that is taxusin in which the hydrogen at the 7β position is replaced by a hydroxy group.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C28H40O9
Net Charge 0
Average Mass 520.61180
Monoisotopic Mass 520.26723
InChI InChI=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
InChIKey CNURLWAZNDLNMK-CNZAUHOSSA-N
SMILES [H][C@@]1(C[C@@]2([H])C[C@]3([H])C(=C)[C@H](C[C@H](O)[C@@]3(C)[C@@H](OC(C)=O)[C@H](OC(C)=O)C(=C1C)C2(C)C)OC(C)=O)OC(C)=O
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
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ChEBI Ontology
Outgoing 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
Synonym Source
7β-hydroxytaxusin UniProt
Citation Waiting for Citations Type Source
15157877 PubMed citation SUBMITTER
Last Modified
19 January 2012
General Comment
2012-01-19 Needed for the new reaction: taxusin + O2 + NADPH + H+ = 7beta-hydroxytaxusin + NADP+ + H2O