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(Q77279014)
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English
Tumonoic acid E
bioactive natural product
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
325.225308472
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₃₁NO₄
0 references
canonical SMILES
O=C(O)C1N(C(=O)C(C)C(O)C(=CC(C)CCCC)C)CCC1
0 references
isomeric SMILES
CCCCC(C)/C=C(\C)C(O)C(C)C(=O)N1CCC[C@H]1C(=O)O
0 references
Identifiers
InChI
InChI=1S/C18H31NO4/c1-5-6-8-12(2)11-13(3)16(20)14(4)17(21)19-10-7-9-15(19)18(22)23/h11-12,14-16,20H,5-10H2,1-4H3,(H,22,23)/b13-11+/t12?,14?,15-,16?/m0/s1
0 references
InChIKey
UUFOMZNZQYHUJH-XTVPCCRVSA-N
2 references
stated in
PubChem
PubChem CID
25111593
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
25111593
language of work or name
English
PubChem CID
25111593
2 references
stated in
PubChem
PubChem CID
25111593
language of work or name
English
matched by identifier from
InChIKey
InChIKey
UUFOMZNZQYHUJH-XTVPCCRVSA-N
UniChem compound ID
32465446
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA003445
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
UUFOMZNZQYHUJH-XTVPCCRVSA-N
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