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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:137499 - Rosarin
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ChEBI Name
Rosarin
ChEBI ID
CHEBI:137499
Stars
This entity has been manually annotated by a third party.
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Formula
C20H28O10
Net Charge
0
Average Mass
428.431
Monoisotopic Mass
428.16825
InChI
InChI=1S/C20H28O10/c21-
9-
12-
14(22)
17(25)
20(29-
12)
28-
10-
13-
15(23)
16(24)
18(26)
19(30-
13)
27-
8-
4-
7-
11-
5-
2-
1-
3-
6-
11/h1-
7,12-
26H,8-
10H2/b7-
4+/t12-
,13+,14-
,15+,16-
,17+,18+,19+,20+/m0/s1
InChIKey
IEBFEMIXXHIISM-YZOUKVLTSA-N
SMILES
O1[C@@H]([C@@H](O)[C@H](O)[C@@H](O)[C@@H]1OC/C=C/C2=CC=CC=C2)CO[C@@H]3O[C@H]([C@H](O)[C@H]3O)CO
ChEBI Ontology
Outgoing
Rosarin (
CHEBI:137499
)
is a
O
-acyl carbohydrate (
CHEBI:52782
)
Manual Xrefs
Databases
8495834
ChemSpider
Rosarin
Wikipedia
View more database links
Last Modified
22 June 2017