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(Q105238670)
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English
5-[2-[1-[2-(4-Hydroxyphenyl)ethyl]-2,5-dioxopyrrol-3-yl]ethyl]-5,6,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylic acid
group of stereoisomers with the chemical formula C₂₈H₃₅NO₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
clerodane diterpenoid
1 reference
inferred from
clerodane diterpenoid
phenethylamine alkaloid
1 reference
inferred from
phenethylamine alkaloid
mass
465.2515232199999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₈H₃₅NO₅
0 references
canonical SMILES
O=C(O)C1=CCCC2C1(C)CCC(C)C2(C)CCC3=CC(=O)N(C3=O)CCC4=CC=C(O)C=C4
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Identifiers
InChI
InChI=1S/C28H35NO5/c1-18-11-14-28(3)22(26(33)34)5-4-6-23(28)27(18,2)15-12-20-17-24(31)29(25(20)32)16-13-19-7-9-21(30)10-8-19/h5,7-10,17-18,23,30H,4,6,11-16H2,1-3H3,(H,33,34)
0 references
InChIKey
RKPIZVKHHGLWAO-UHFFFAOYSA-N
0 references
PubChem CID
163068777
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
RKPIZVKHHGLWAO-UHFFFAOYSA-N
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