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(Q75052878)
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English
Clavirolide A
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
17-hydroxy-3,7,10,14-tetramethyl-16-oxatricyclo[8.6.1.0¹³,¹⁷]heptadeca-7,13-diene-5,15-dione
1 reference
based on heuristic
inferred from SMILES
mass
332.198759376
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₂₈O₄
0 references
canonical SMILES
O=C1OC2CC(C)CC(=O)CC(=CCC3(C)CCC(=C1C)C23O)C
0 references
isomeric SMILES
C[C@H]1C[C@@H]2[C@@]3(C(=C(C(=O)O2)C)CC[C@]3(C/C=C(/CC(=O)C1)\C)C)O
0 references
found in taxon
Clavularia viridis
2 references
stated in
Clavudiol A and clavirolide A, two marine dolabellane diterpenes from the soft coral Clavularia viridis
stated in
Clavudiol A and clavirolide A, two marine dolabellane diterpenes from the soft coral Clavularia viridis
Identifiers
InChI
InChI=1S/C20H28O4/c1-12-5-7-19(4)8-6-16-14(3)18(22)24-17(20(16,19)23)11-13(2)10-15(21)9-12/h5,13,17,23H,6-11H2,1-4H3/b12-5+/t13-,17-,19-,20-/m1/s1
0 references
InChIKey
JVYXSCVDLGVIRM-NOYREHSQSA-N
0 references
PubChem CID
21671023
2 references
stated in
PubChem
PubChem CID
21671023
language of work or name
English
matched by identifier from
InChIKey
InChIKey
JVYXSCVDLGVIRM-NOYREHSQSA-N
ChEBI ID
197600
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C20H28O4/c1-12-5-7-19(4)8-6-16-14(3)18(22)24-17(20(16,19)23)11-13(2)10-15(21)9-12/h5,13,17,23H,6-11H2,1-4H3/b12-5+/t13-,17-,19-,20-/m1/s1
UniChem compound ID
50749003
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA000078
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
JVYXSCVDLGVIRM-NOYREHSQSA-N
LIPID MAPS ID
LMPR0104240018
1 reference
stated in
LIPID MAPS
reference URL
http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download
retrieved
31 December 2022
InChIKey
JVYXSCVDLGVIRM-NOYREHSQSA-N
based on heuristic
InChIKey match
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