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(Q104910244)
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English
(3aS,6R,6aR)-6-hexyl-3-methylidene-dihydro-3aH-furo[2,3-c]furan-2,4-dione
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
6-hexyl-3-methylidene-6,6a-dihydro-3aH-furo[3,4-b]furan-2,4-dione
1 reference
based on heuristic
inferred from SMILES
mass
238.120509056
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₁₈O₄
0 references
canonical SMILES
O=C1OC2C(OC(=O)C2C1=C)CCCCCC
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isomeric SMILES
C=C1C(=O)O[C@@H]2[C@H]1C(=O)O[C@@H]2CCCCCC
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found in taxon
Sporothrix
1 reference
stated in
Biologically active metabolites from fungi. 3. Sporothriolide, discosiolide, and 4-epi-ethisolide--new furofurandiones from Sporothrix sp., Discosia sp., and Pezicula livida
Hypoxylon monticulosum
1 reference
stated in
Sporothriolide-Related Compounds from the Fungus Hypoxylon monticulosum CLL-205 Isolated from a Sphaerocladina Sponge from the Tahiti Coast.
Hypomontagnella monticulosa
1 reference
stated in
Sporothriolide-Related Compounds from the Fungus Hypoxylon monticulosum CLL-205 Isolated from a Sphaerocladina Sponge from the Tahiti Coast.
Identifiers
InChI
InChI=1S/C13H18O4/c1-3-4-5-6-7-9-11-10(13(15)16-9)8(2)12(14)17-11/h9-11H,2-7H2,1H3/t9-,10+,11+/m1/s1
0 references
InChIKey
AENZSPQGLJVLND-VWYCJHECSA-N
0 references
CAS Registry Number
154799-92-5
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
10944473
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
AENZSPQGLJVLND-VWYCJHECSA-N
ChEBI ID
141338
mapping relation type
exact match
2 references
stated in
ChEBI release 2021-03-01
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C13H18O4/c1-3-4-5-6-7-9-11-10(13(15)16-9)8(2)12(14)17-11/h9-11H,2-7H2,1H3/t9-,10+,11+/m1/s1
UniChem compound ID
33123446
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA017246
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
AENZSPQGLJVLND-VWYCJHECSA-N
Probes And Drugs ID
PD131473
0 references
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