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(Q105154634)
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English
(13-hydroxy-5b,8,8,11a,13a-pentamethyl-1-oxo-4,5,5a,6,7,7a,9,10,11,11b,12,13-dodecahydro-3H-phenanthro[2,1-e][2]benzofuran-4-yl) acetate
group of stereoisomers with the chemical formula C₂₇H₄₀O₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
scalarane sesterterpenoid
1 reference
inferred from
scalarane sesterterpenoid
mass
444.28757438
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₇H₄₀O₅
0 references
canonical SMILES
O=C1OCC2=C1C3(C)C(O)CC4C5(C)CCCC(C)(C)C5CCC4(C)C3CC2OC(=O)C
0 references
found in taxon
Hyrtios gumminae
1 reference
stated in
Bioactive scalaranes from the Thai sponge Hyrtios gumminae
Hyrtios erectus
1 reference
stated in
Hyrtioerectines A-C, cytotoxic alkaloids from the red sea sponge hyrtioserectus.
Identifiers
InChI
InChI=1S/C27H40O5/c1-15(28)32-17-12-20-26(5)11-8-18-24(2,3)9-7-10-25(18,4)19(26)13-21(29)27(20,6)22-16(17)14-31-23(22)30/h17-21,29H,7-14H2,1-6H3
0 references
InChIKey
LOCDSBKFSVHNIV-UHFFFAOYSA-N
0 references
PubChem CID
73205409
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LOCDSBKFSVHNIV-UHFFFAOYSA-N
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