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(Q77375584)
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Epicoccamide
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
3-(1-hydroxy-2-methyl-16-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hexadecylidene)-1,5-dimethylpyrrolidine-2,4-dione
1 reference
based on heuristic
inferred from SMILES
mass
557.356382212
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₉H₅₁NO₉
0 references
canonical SMILES
O=C1C(C(=O)C(N1C)C)=C(O)C(C)CCCCCCCCCCCCCCOC2OC(CO)C(O)C(O)C2O
0 references
isomeric SMILES
CC(CCCCCCCCCCCCCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O)C(O)=C1C(=O)C(C)N(C)C1=O
0 references
found in taxon
Epicoccum nigrum
1 reference
stated in
Epicoccamide, a novel secondary metabolite from a jellyfish-derived culture of Epicoccum purpurascens
Epicoccum purpurascens
1 reference
stated in
Epicoccamide, a novel secondary metabolite from a jellyfish-derived culture of Epicoccum purpurascens
Identifiers
InChI
InChI=1S/C29H51NO9/c1-19(23(32)22-24(33)20(2)30(3)28(22)37)16-14-12-10-8-6-4-5-7-9-11-13-15-17-38-29-27(36)26(35)25(34)21(18-31)39-29/h19-21,25-27,29,31-32,34-36H,4-18H2,1-3H3/t19?,20?,21-,25-,26+,27+,29-/m1/s1
0 references
InChIKey
GLMMQSHEMIVRFP-XIECNSLGSA-N
2 references
stated in
PubChem
PubChem CID
101229568
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
101229568
language of work or name
English
PubChem CID
101229568
2 references
stated in
PubChem
PubChem CID
101229568
language of work or name
English
matched by identifier from
InChIKey
InChIKey
GLMMQSHEMIVRFP-XIECNSLGSA-N
ChEBI ID
203122
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C29H51NO9/c1-19(23(32)22-24(33)20(2)30(3)28(22)37)16-14-12-10-8-6-4-5-7-9-11-13-15-17-38-29-27(36)26(35)25(34)21(18-31)39-29/h19-21,25-27,29,31-32,34-36H,4-18H2,1-3H3/t19?,20?,21-,25-,26+,27+,29-/m1/s1
UniChem compound ID
102935635
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA006027
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
GLMMQSHEMIVRFP-XIECNSLGSA-N
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