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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:3250 - Byakangelicin
Main
ChEBI Ontology
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ChEBI Name
Byakangelicin
ChEBI ID
CHEBI:3250
Stars
This entity has been manually annotated by a third party.
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Formula
C17H18O7
Net Charge
0
Average Mass
334.321
Monoisotopic Mass
334.10525
InChI
InChI=1S/C17H18O7/c1-
17(2,20)
11(18)
8-
23-
16-
14-
10(6-
7-
22-
14)
13(21-
3)
9-
4-
5-
12(19)
24-
15(9)
16/h4-
7,11,18,20H,8H2,1-
3H3/t11-
/m1/s1
InChIKey
PKRPFNXROFUNDE-LLVKDONJSA-N
SMILES
COc1c2ccoc2c(OC[C@@H](O)C(C)(C)O)c2oc(=O)ccc12
ChEBI Ontology
Outgoing
Byakangelicin (
CHEBI:3250
)
is a
psoralens (
CHEBI:26369
)
Synonym
Source
Byakangelicin
KEGG COMPOUND
Manual Xrefs
Databases
C00002453
KNApSAcK
C09141
KEGG COMPOUND
View more database links
Registry Number
Type
Source
482-25-7
CAS Registry Number
KEGG COMPOUND
Last Modified
28 July 2014