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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:69382 - croomine
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ChEBI Ontology
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ChEBI Name
croomine
ChEBI ID
CHEBI:69382
Definition
A natural product found particularly in
Stemona tuberosa
and
Stemona phyllantha
.
Stars
This entity has been manually annotated by a third party.
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Formula
C18H27NO4
Net Charge
0
Average Mass
321.41130
Monoisotopic Mass
321.19401
InChI
InChI=1S/C18H27NO4/c1-
11-
9-
14(22-
16(11)
20)
13-
5-
6-
15-
18(7-
3-
4-
8-
19(13)
15)
10-
12(2)
17(21)
23-
18/h11-
15H,3-
10H2,1-
2H3/t11-
,12+,13-
,14-
,15-
,18-
/m0/s1
InChIKey
FOGTVYCUHQOMDW-QANXDEHQSA-N
SMILES
[H][C@]1(C[C@H](C)C(=O)O1)[C@]1([H])CC[C@]2([H])N1CCCC[C@]21C[C@@H](C)C(=O)O1
Metabolite of Species
Details
Stemona tuberosa
(NCBI:txid167572)
Found in tuberous root
(BTO:0001309)
. MeOH extract of dried underground parts(tuberous roots and rhizomes) of strain HG 890 See:
PubMed
Stemona tuberosa
(NCBI:txid167572)
Found in rhizome
(BTO:0001181)
. MeOH extract of dried underground parts(tuberous roots and rhizomes) of strain HG 890 See:
PubMed
Stemona phyllantha
(NCBI:txid492017)
Found in rhizome
(BTO:0001181)
. MeOH extract of dried underground parts(tuberous roots and rhizomes) See:
PubMed
Stemona phyllantha
(NCBI:txid492017)
Found in tuberous root
(BTO:0001309)
. MeOH extract of dried underground parts(tuberous roots and rhizomes) See:
PubMed
Croomia heterosepala
(NCBI:txid49664)
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.
(via
alkaloid
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
croomine (
CHEBI:69382
)
has role
metabolite (
CHEBI:25212
)
croomine (
CHEBI:69382
)
is a
alkaloid (
CHEBI:22315
)
Synonym
Source
(2S,3'S,4R,9a'S)-
4-
Methyl-
3'-
[(2S,4S)-
4-
methyl-
5-
oxotetrahydro-
2-
furanyl]decahydro-
5H-
spiro[furan-
2,9'-
pyrrolo[1,2-
a]azepin]-
5-
one
ChEBI
Registry Number
Type
Source
71239-66-2
CAS Registry Number
ChemIDplus
Citation
Type
Source
21902195
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:organonitrogen heterocyclic compound(CHEBI:38101); ISA:organic heterobicyclic compound(CHEBI:27171); ISA:azepanes(CHEBI:46986); ISA:N-alkylpyrrolidine(CHEBI:46775); ISA:gamma-lactone(CHEBI:37581); ISA:oxolanes(CHEBI:26912); ISA:tertiary amine(CHEBI:32876); ISA:carboxylic ester(CHEBI:33308); ISA:ether(CHEBI:25698); ISA:monocarboxylic acid(CHEBI:25384); ISA:carbonyl compound(CHEBI:36586);