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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:136940 - bacteriohopane-32,33, 34-triol-35-carbamate
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ChEBI Name
bacteriohopane-32,33, 34-triol-35-carbamate
ChEBI ID
CHEBI:136940
Stars
This entity has been manually annotated by a third party.
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Formula
C36H63NO5
Net Charge
0
Average Mass
589.890
Monoisotopic Mass
589.47062
InChI
InChI=1S/C36H63NO5/c1-
22(9-
10-
25(38)
30(40)
26(39)
21-
42-
31(37)
41)
23-
13-
18-
33(4)
24(23)
14-
19-
35(6)
28(33)
11-
12-
29-
34(5)
17-
8-
16-
32(2,3)
27(34)
15-
20-
36(29,35)
7/h22-
30,38-
40H,8-
21H2,1-
7H3,(H2,37,41)
/t22?,23?,24?,25?,26?,27?,28?,29?,30?,33-
,34-
,35+,36+/m0/s1
InChIKey
IJJMTQSOTJFUOJ-VEJRBLLVSA-N
SMILES
C(C(C1CC[C@]2(C1CC[C@]3([C@@]4(CCC5C(CCC[C@@]5(C4CCC32)C)(C)C)C)C)C)C)CC(C(C(COC(N)=O)O)O)O
ChEBI Ontology
Outgoing
bacteriohopane-32,33, 34-triol-35-carbamate (
CHEBI:136940
)
is a
hopanoid (
CHEBI:51963
)
Manual Xref
Database
LMPR04000014
LIPID MAPS
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Last Modified
02 May 2017