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ChEBI
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CHEBI:66198 - Tasumatrol K
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ChEBI Ontology
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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.
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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);