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(Q73402129)
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culmorin
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
sesquiterpenoid
0 references
diol
0 references
cyclohimachalane sesquiterpenoid
1 reference
based on heuristic
inferred from SMILES
part of
culmorin biosynthetic process
subject has role
product
1 reference
stated in
Gene Ontology release 2022-07-01
mass
238.193280072
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
(1R,2S,7S,8S,9R,11R)-2,6,6,9-tetramethyltricyclo[5.4.0.02,9]undecane-8,11-diol
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₆O₂
0 references
canonical SMILES
CC1(C)CCCC2(C)C3C(O)CC2(C)C(O)C31
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C[C@@]12CCCC([C@H]3[C@@H]1[C@@H](C[C@@]2([C@@H]3O)C)O)(C)C
0 references
produced by
Fusarium culmorum
0 references
Identifiers
InChI
InChI=1S/C15H26O2/c1-13(2)6-5-7-14(3)10-9(16)8-15(14,4)12(17)11(10)13/h9-12,16-17H,5-8H2,1-4H3/t9-,10+,11+,12-,14-,15-/m1/s1
0 references
InChIKey
VWMGBHVRRNKOAE-ZLSAFIHNSA-N
2 references
stated in
ChEBI release 2019-10-02
stated in
ChEBI release 2020-09-01
PubChem CID
21119328
1 reference
matched by identifier from
InChIKey
InChIKey
VWMGBHVRRNKOAE-ZLSAFIHNSA-N
ChEBI ID
143197
mapping relation type
exact match
2 references
stated in
ChEBI release 2019-10-02
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C15H26O2/c1-13(2)6-5-7-14(3)10-9(16)8-15(14,4)12(17)11(10)13/h9-12,16-17H,5-8H2,1-4H3/t9-,10+,11+,12-,14-,15-/m1/s1
UniChem compound ID
55673975
1 reference
stated in
UniChem
UNII
4JEZ89Z9LA
1 reference
matched by identifier from
InChIKey
InChIKey
VWMGBHVRRNKOAE-ZLSAFIHNSA-N
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