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CHEBI:67677 - Longikaurin A
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ChEBI Name
Longikaurin A
ChEBI ID
CHEBI:67677
Definition
A natural product found in
Isodon adenolomus
.
Stars
This entity has been manually annotated by a third party.
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Formula
C20H28O5
Net Charge
0
Average Mass
348.43330
Monoisotopic Mass
348.19367
InChI
InChI=1S/C20H28O5/c1-
10-
11-
5-
6-
12-
18-
8-
4-
7-
17(2,3)
13(18)
16(23)
20(24,25-
9-
18)
19(12,14(10)
21)
15(11)
22/h11-
13,15-
16,22-
24H,1,4-
9H2,2-
3H3/t11-
,12+,13-
,15-
,16+,18-
,19+,20-
/m1/s1
InChIKey
PSVHVXLCVSKJGM-NIPWPZGFSA-N
SMILES
[H][C@]12CC[C@@]3([H])[C@]45CCCC(C)(C)[C@@]4([H])[C@H](O)[C@@](O)(OC5)[C@]3([C@@H]1O)C(=O)C2=C
Metabolite of Species
Details
Isodon adenolomus
(NCBI:txid662903)
Found in aerial part
(BTO:0001658)
. 70% aqueous acetone extract of air-dried and powdered aerial parts See:
PubMed
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
Longikaurin A (
CHEBI:67677
)
has role
metabolite (
CHEBI:25212
)
Longikaurin A (
CHEBI:67677
)
is a
kaurane diterpenoid (
CHEBI:53666
)
Synonym
Source
ent-Kaur-16-en-15-one, 7,20-epoxy-6,7,14-trihydroxy-,(6beta,7alpha,14R)-
ChEBI
Registry Number
Type
Source
75207-67-9
CAS Registry Number
ChemIDplus
Citation
Type
Source
21534539
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:oxanes(CHEBI:46942); ISA:secondary alcohol(CHEBI:35681); ISA:polyol(CHEBI:26191); ISA:ketone(CHEBI:17087); ISA:hemiacetal(CHEBI:5653); ISA:organic hydroxy compound(CHEBI:33822);