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Signatures
KEGG Pathways
Results for:
Species: Epichloe typhina
Signature
(1S,2R,3S)-1,2-dimethyl-3-(6-methylhepta-1,5-dien-2-yl)cyclopentan-1-ol
Compound Details
Synonymous names
Chokol K
Microorganism:
Yes
IUPAC name
(1S,2R,3S)-1,2-dimethyl-3-(6-methylhepta-1,5-dien-2-yl)cyclopentan-1-ol
SMILES
CC1C(CCC1(C)O)C(=C)CCC=C(C)C
Inchi
InChI=1S/C15H26O/c1-11(2)7-6-8-12(3)14-9-10-15(5,16)13(14)4/h7,13-14,16H,3,6,8-10H2,1-2,4-5H3/t13-,14-,15+/m1/s1
Formula
C
1
5
H
2
6
O
PubChem ID
53242582
Molweight
222.372
LogP
3.81
Atoms
42
Bonds
42
H-bond Acceptor
1
H-bond Donor
1
Chemical Classification
alcohols
terpenes
mVOC Specific Details
Microorganisms emitting the compound
Kingdom
Species
Biological Function
Origin/Habitat
Reference
Fungi
Epichloe Sylvatica
Schiestl et al. 2006
Fungi
Epichloe Typhina
Schiestl et al. 2006
Method
Kingdom
Species
Growth Medium
Applied Method
Verification
Fungi
Epichloe Sylvatica
GC-EAD
yes
Fungi
Epichloe Typhina
GC-EAD
yes
2-hydroxy-3-phenyl-2H-furan-5-one
Compound Details
Synonymous names
XXWIUGNNANJILR-UHFFFAOYSA-N
SCHEMBL5261044
78920-11-3
5-Hydroxy-4-phenyl-2(5H)-furanone
5-hydroxy-4-phenylfuran-2(5H)-one
2(5H)-Furanone, 5-hydroxy-4-phenyl-
Microorganism:
Yes
IUPAC name
2-hydroxy-3-phenyl-2H-furan-5-one
SMILES
C1=CC=C(C=C1)C2=CC(=O)OC2O
Inchi
InChI=1S/C10H8O3/c11-9-6-8(10(12)13-9)7-4-2-1-3-5-7/h1-6,10,12H
Formula
C
1
0
H
8
O
3
PubChem ID
12864804
Molweight
176.171
LogP
1.69
Atoms
21
Bonds
22
H-bond Acceptor
2
H-bond Donor
1
Chemical Classification
benzenoids
lactones
esters
alcohols
mVOC Specific Details
Microorganisms emitting the compound
Kingdom
Species
Biological Function
Origin/Habitat
Reference
Fungi
Epichloe Typhina
Koshino et al. 1993
Method
Kingdom
Species
Growth Medium
Applied Method
Verification
Fungi
Epichloe Typhina
no
(3S,4R)-8-hydroxy-7-(hydroxymethyl)-3,4-dimethyl-3,4-dihydroisochromen-1-one
Compound Details
Synonymous names
Gamahorin
Microorganism:
Yes
IUPAC name
(3S,4R)-8-hydroxy-7-(hydroxymethyl)-3,4-dimethyl-3,4-dihydroisochromen-1-one
SMILES
CC1C(OC(=O)C2=C1C=CC(=C2O)CO)C
Inchi
InChI=1S/C12H14O4/c1-6-7(2)16-12(15)10-9(6)4-3-8(5-13)11(10)14/h3-4,6-7,13-14H,5H2,1-2H3/t6-,7-/m0/s1
Formula
C
1
2
H
1
4
O
4
PubChem ID
101630976
Molweight
222.24
LogP
2.18
Atoms
30
Bonds
31
H-bond Acceptor
3
H-bond Donor
2
Chemical Classification
benzenoids
lactones
heterocyclic compounds
alcohols
mVOC Specific Details
Microorganisms emitting the compound
Kingdom
Species
Biological Function
Origin/Habitat
Reference
Fungi
Epichloe Typhina
Koshino et al. 1992
Method
Kingdom
Species
Growth Medium
Applied Method
Verification
Fungi
Epichloe Typhina
no