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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
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CHEBI:82527 - Ptaquiloside
Main
ChEBI Ontology
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ChEBI Name
Ptaquiloside
ChEBI ID
CHEBI:82527
Stars
This entity has been manually annotated by a third party.
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Formula
C20H30O8
Net Charge
0
Average Mass
398.44740
Monoisotopic Mass
398.19407
InChI
InChI=1S/C20H30O8/c1-
9-
6-
20(28-
17-
15(25)
14(24)
13(23)
11(8-
21)
27-
17)
7-
10(2)
19(4-
5-
19)
18(3,26)
16(20)
12(9)
22/h7,9,11,13-
17,21,23-
26H,4-
6,8H2,1-
3H3/t9-
,11-
,13-
,14+,15-
,16?,17+,18+,20-
/m1/s1
InChIKey
GPHSJPVUEZFIDE-VGFVQWJBSA-N
SMILES
C[C@@H]1C[C@@]2(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C=C(C)C3(CC3)[C@@](C)(O)C2C1=O
ChEBI Ontology
Outgoing
Ptaquiloside (
CHEBI:82527
)
is a
glycoside (
CHEBI:24400
)
Synonym
Source
Braxin C
KEGG COMPOUND
Manual Xref
Database
C19515
KEGG COMPOUND
View more database links
Registry Number
Type
Source
87625-62-5
CAS Registry Number
KEGG COMPOUND