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Haliangicin B
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
methyl (2Z,4Z,6E,8E)-11-(3-ethenyl-2-methyloxiran-2-yl)-3,4-dimethoxy-6,9,10-trimethylundeca-2,4,6,8-tetraenoate
1 reference
based on heuristic
inferred from SMILES
mass
376.224974124
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Haliangicin C
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
Haliangicin D
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
Cis-haliangicin
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₂H₃₂O₅
0 references
canonical SMILES
O=C(OC)C=C(OC)C(OC)=CC(=CC=C(C)C(C)CC1(OC1C=C)C)C
0 references
isomeric SMILES
C=C[C@@H]1O[C@@]1(C)C[C@@H](C)/C(C)=C/C=C(C)\C=C(OC)\C(=C\C(=O)OC)OC
0 references
found in taxon
Haliangium ochraceum
1 reference
stated in
New Haliangicin Isomers, Potent Antifungal Metabolites Produced by a Marine Myxobacterium
Identifiers
InChI
InChI=1S/C22H32O5/c1-9-20-22(5,27-20)14-17(4)16(3)11-10-15(2)12-18(24-6)19(25-7)13-21(23)26-8/h9-13,17,20H,1,14H2,2-8H3/b15-10-,16-11+,18-12-,19-13-/t17-,20+,22+/m1/s1
0 references
InChIKey
XIKGETOZQXNXHV-FBPBFTCHSA-N
0 references
PubChem CID
139588860
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XIKGETOZQXNXHV-FBPBFTCHSA-N
ChEBI ID
220755
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C22H32O5/c1-9-20-22(5,27-20)14-17(4)16(3)11-10-15(2)12-18(24-6)19(25-7)13-21(23)26-8/h9-13,17,20H,1,14H2,2-8H3/b15-10-,16-11+,18-12-,19-13-/t17-,20+,22+/m1/s1
UniChem compound ID
170911824
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA020544
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XIKGETOZQXNXHV-FBPBFTCHSA-N
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