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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:4650 - Diprenorphine
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ChEBI Ontology
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ChEBI Name
Diprenorphine
ChEBI ID
CHEBI:4650
Stars
This entity has been manually annotated by a third party.
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Formula
C26H35NO4
Net Charge
0
Average Mass
425.561
Monoisotopic Mass
425.25661
InChI
InChI=1S/C26H35NO4/c1-
23(2,29)
18-
13-
24-
8-
9-
26(18,30-
3)
22-
25(24)
10-
11-
27(14-
15-
4-
5-
15)
19(24)
12-
16-
6-
7-
17(28)
21(31-
22)
20(16)
25/h6-
7,15,18-
19,22,28-
29H,4-
5,8-
14H2,1-
3H3/t18-
,19-
,22-
,24-
,25+,26-
/m1/s1
InChIKey
OIJXLIIMXHRJJH-KNLIIKEYSA-N
SMILES
CO[C@]12CC[C@@]3(C[C@@H]1C(C)(C)O)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1CC1CC1)c45
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
Diprenorphine (
CHEBI:4650
)
is a
morphinane alkaloid (
CHEBI:25418
)
Synonym
Source
Diprenorphine
KEGG COMPOUND
Manual Xrefs
Databases
1906
VSDB
C11794
KEGG COMPOUND
D07863
KEGG DRUG
View more database links
Registry Number
Type
Source
14357-78-9
CAS Registry Number
KEGG COMPOUND
Last Modified
28 July 2014