CHEBI:66198 - Tasumatrol K

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ChEBI Name Tasumatrol K
ChEBI ID CHEBI:66198
Definition A natural product found in Taxus sumatrana.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C29H44O8
Net Charge 0
Average Mass 520.65490
Monoisotopic Mass 520.30362
InChI InChI=1S/C29H44O8/c1-14-12-21(37-27(34)15(2)17(4)30)25-26(36-19(6)32)24-16(3)20(33)10-11-29(24,9)13-22(35-18(5)31)23(14)28(25,7)8/h15,17,20-22,24-26,30,33H,3,10-13H2,1-2,4-9H3/t15-,17+,20+,21+,22+,24+,25+,26+,29+/m1/s1
InChIKey NYZTVYMLRZLUBV-UOIGVGIGSA-N
SMILES [H][C@]12[C@H](CC(C)=C([C@H](C[C@]3(C)CC[C@H](O)C(=C)[C@@]3([H])[C@@H]1OC(C)=O)OC(C)=O)C2(C)C)OC(=O)[C@H](C)[C@H](C)O
Metabolite of Species Details
Taxus sumatrana (NCBI:txid450883) Found in twig (BTO:0001411). See: DOI
Taxus sumatrana (NCBI:txid450883) Found in leaf (BTO:0000713). See: DOI
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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Tasumatrol K (CHEBI:66198) has role metabolite (CHEBI:25212)
Tasumatrol K (CHEBI:66198) is a taxane diterpenoid (CHEBI:50367)
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:3-hydroxy carboxylic acid(CHEBI:61355); ISA:fatty acid ester(CHEBI:35748); ISA:organic hydroxy compound(CHEBI:33822); ISA:secondary alcohol(CHEBI:35681); ISA:carboxylic ester(CHEBI:33308); ISA:monocarboxylic acid(CHEBI:25384); ISA:ether(CHEBI:25698); ISA:organonitrogen compound(CHEBI:35352); ISA:carbonyl compound(CHEBI:36586);