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(Q59315549)
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English
hamigeran A
chemical compound
methyl 7-bromo-4β,6-dihydroxy-1β-isopropyl-3aα,8-dimethyl-5-oxo-1a,3a,4,5-terahydrocyclopenta[a]naphthalene-4-carboxylate
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Statements
instance of
type of chemical entity
0 references
subclass of
Methyl 7-bromo-4,6-dihydroxy-3a,8-dimethyl-5-oxo-1-propan-2-yl-1,2,3,9b-tetrahydrocyclopenta[a]naphthalene-4-carboxylate
1 reference
based on heuristic
inferred from InChIKey
mass
424.088536
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₂₀H₂₅BrO₅
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC1=C(C(=C2C(=C1)C3C(CCC3(C(C2=O)(C(=O)OC)O)C)C(C)C)O)Br
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isomeric SMILES
CC1=C(C(=C2C(=C1)[C@H]3[C@H](CC[C@]3([C@@](C2=O)(C(=O)OC)O)C)C(C)C)O)Br
0 references
found in taxon
Hamigera tarangaensis
3 references
stated in
Chemistry of sponges. 19. Novel bioactive metabolites from Hamigera tarangaensis
stated in
Chemistry of sponges. 19. Novel bioactive metabolites from Hamigera tarangaensis
stated in
Chemistry of sponges. 19. Novel bioactive metabolites from Hamigera tarangaensis
described by source
Total synthesis of hamigerans and analogues thereof. Photochemical generation and Diels-Alder trapping of hydroxy-o-quinodimethanes
0 references
Identifiers
InChI
InChI=1S/C20H25BrO5/c1-9(2)11-6-7-19(4)14(11)12-8-10(3)15(21)16(22)13(12)17(23)20(19,25)18(24)26-5/h8-9,11,14,22,25H,6-7H2,1-5H3/t11-,14-,19-,20-/m1/s1
0 references
InChIKey
ZUMYUUHSQZYLPD-VKUYIICUSA-N
0 references
CAS Registry Number
255882-01-0
0 references
PubChem CID
10025421
1 reference
matched by identifier from
InChIKey
InChIKey
ZUMYUUHSQZYLPD-VKUYIICUSA-N
UniChem compound ID
484478
1 reference
stated in
UniChem
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