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CHEBI:70490 - Dihydrocubebin, rel-
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ChEBI Name
Dihydrocubebin, rel-
ChEBI ID
CHEBI:70490
Definition
A natural product found in
Piper sanguineispicum
.
Stars
This entity has been manually annotated by a third party.
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Formula
C20H22O6
Net Charge
0
Average Mass
358.38510
Monoisotopic Mass
358.14164
InChI
InChI=1S/C20H22O6/c21-
9-
15(5-
13-
1-
3-
17-
19(7-
13)
25-
11-
23-
17)
16(10-
22)
6-
14-
2-
4-
18-
20(8-
14)
26-
12-
24-
18/h1-
4,7-
8,15-
16,21-
22H,5-
6,9-
12H2/t15-
,16-
/m1/s1
InChIKey
JKCVMTYNARDGET-HZPDHXFCSA-N
SMILES
OC[C@@H](Cc1ccc2OCOc2c1)[C@@H](CO)Cc1ccc2OCOc2c1
Metabolite of Species
Details
Piper sanguineispicum
(IPNI:199083-2)
Found in leaf
(BTO:0000713)
. 90% ethanolic extract of dried leaves 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
Dihydrocubebin, rel- (
CHEBI:70490
)
has role
metabolite (
CHEBI:25212
)
Dihydrocubebin, rel- (
CHEBI:70490
)
is a
lignan (
CHEBI:25036
)
Synonym
Source
rel-1,4-Butanediol, 2,3-bis(1,3-benzodioxol-5-ylmethyl)-, (R-(R,R))-
ChEBI
Registry Number
Type
Source
24563-03-9
CAS Registry Number
ChemIDplus
Citation
Type
Source
20954722
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:benzodioxoles(CHEBI:38298); ISA:benzenoid aromatic compound(CHEBI:33836); ISA:acetal(CHEBI:59769); ISA:primary alcohol(CHEBI:15734);