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(Q105112548)
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English
10,12,13,14,23-pentahydroxy-6,10,19-trimethyl-24-oxa-4-azaheptacyclo[12.12.0.0²,¹¹.0⁴,⁹.0¹⁵,²⁵.0¹⁸,²³.0¹⁹,²⁵]hexacosan-22-yl acetate
group of stereoisomers with the chemical formula C₂₉H₄₅NO₈
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Statements
instance of
group of stereoisomers
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subclass of
cevane alkaloid
1 reference
inferred from
cevane alkaloid
mass
535.3145173999998
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₉H₄₅NO₈
0 references
canonical SMILES
O=C(OC1CCC2(C)C3CCC4C5(O)C(O)C(O)C6C(CN7CC(C)CCC7C6(O)C)C5CC42OC13O)C
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Identifiers
InChI
InChI=1S/C29H45NO8/c1-14-5-8-20-26(4,34)22-16(13-30(20)12-14)17-11-27-19(28(17,35)24(33)23(22)32)7-6-18-25(27,3)10-9-21(37-15(2)31)29(18,36)38-27/h14,16-24,32-36H,5-13H2,1-4H3
0 references
InChIKey
IGDRXLIXNAWBBF-UHFFFAOYSA-N
0 references
PubChem CID
574506
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IGDRXLIXNAWBBF-UHFFFAOYSA-N
UniChem compound ID
42680555
1 reference
stated in
UniChem
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