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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:135847 - biricodar
Main
ChEBI Ontology
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ChEBI Name
biricodar
ChEBI ID
CHEBI:135847
Stars
This entity has been manually annotated by a third party.
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Formula
C34H41N3O7
Net Charge
0
Average Mass
603.707
Monoisotopic Mass
603.29445
InChI
InChI=1S/C34H41N3O7/c1-
41-
29-
20-
26(21-
30(42-
2)
32(29)
43-
3)
31(38)
33(39)
37-
19-
5-
4-
16-
28(37)
34(40)
44-
27(14-
6-
10-
24-
12-
8-
17-
35-
22-
24)
15-
7-
11-
25-
13-
9-
18-
36-
23-
25/h8-
9,12-
13,17-
18,20-
23,27-
28H,4-
7,10-
11,14-
16,19H2,1-
3H3/t28-
/m0/s1
InChIKey
CGVWPQOFHSAKRR-NDEPHWFRSA-N
SMILES
C(C(=O)C1=CC(OC)=C(C(=C1)OC)OC)(=O)N2[C@H](C(OC(CCCC=3C=CC=NC3)CCCC=4C=CC=NC4)=O)CCCC2
ChEBI Ontology
Outgoing
biricodar (
CHEBI:135847
)
is a
α-amino acid ester (
CHEBI:46874
)
Synonyms
Sources
biricodar dicitrate
DrugCentral
incel
DrugCentral
VX 710
DrugCentral
Manual Xref
Database
3028
DrugCentral
View more database links
Registry Number
Type
Source
159997-94-1
CAS Registry Number
DrugCentral
Last Modified
23 February 2017