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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:9433 - Tellimagrandin I
Main
ChEBI Ontology
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ChEBI Name
Tellimagrandin I
ChEBI ID
CHEBI:9433
Stars
This entity has been manually annotated by a third party.
Supplier Information
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Formula
C34H26O22
Net Charge
0
Average Mass
786.558
Monoisotopic Mass
786.09157
InChI
InChI=1S/C34H26O22/c35-
12-
1-
8(2-
13(36)
21(12)
41)
30(47)
55-
28-
27-
18(53-
34(51)
29(28)
56-
31(48)
9-
3-
14(37)
22(42)
15(38)
4-
9)
7-
52-
32(49)
10-
5-
16(39)
23(43)
25(45)
19(10)
20-
11(33(50)
54-
27)
6-
17(40)
24(44)
26(20)
46/h1-
6,18,27-
29,34-
46,51H,7H2/t18-
,27-
,28+,29-
,34?/m1/s1
InChIKey
YKDNTEQLKGYZHT-HTCCRONFSA-N
SMILES
OC1O[C@@H]
2COC(=O)
c3cc(O)
c(O)
c(O)
c3-
c3c(O)
c(O)
c(O)
cc3C(=O)
O[C@H]
2[C@H]
(OC(=O)
c2cc(O)
c(O)
c(O)
c2)
[C@H]
1OC(=O)
c1cc(O)
c(O)
c(O)
c1
Roles Classification
Application
(s):
astringent
A compound that causes the contraction of body tissues, typically used to reduce bleeding from minor abrasions.
(via
tannin
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
Tellimagrandin I (
CHEBI:9433
)
is a
tannin (
CHEBI:26848
)
Synonyms
Sources
1-Desgalloyleugeniin
KEGG COMPOUND
Tellimagrandin I
KEGG COMPOUND
Manual Xrefs
Databases
C00002938
KNApSAcK
C10241
KEGG COMPOUND
View more database links
Registry Number
Type
Source
79786-08-6
CAS Registry Number
KEGG COMPOUND
Last Modified
28 July 2014