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(Q103817778)
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English
CID 4482272
group of stereoisomers with the chemical formula C₃₄H₄₄O₉
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Statements
instance of
group of stereoisomers
0 references
subclass of
ring-cleaved tetranortriterpenoid
1 reference
inferred from
ring-cleaved tetranortriterpenoid
mass
596.298532988
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₄H₄₄O₉
0 references
canonical SMILES
O=C(OC1CC(OC(=O)C)C2(C)COC3C4OC5C(=C(C)C(C6=COC=C6)C5)C4(C)C(CC(=O)OC)C1(C)C32)C(=CC)C
0 references
found in taxon
Azadirachta indica
1 reference
stated in
The melanogenesis-inhibitory, anti-inflammatory, and chemopreventive effects of limonoids in n-hexane extract of Azadirachta indica A. Juss. (neem) seeds
Melia azedarach
1 reference
stated in
Chemical characterization of Azadirachta indica grafted on Melia azedarach and analyses of azadirachtin by HPLC-MS-MS (SRM) and meliatoxins by MALDI-MS.
Identifiers
InChI
InChI=1S/C34H44O9/c1-9-17(2)31(37)43-25-14-24(41-19(4)35)32(5)16-40-28-29(32)33(25,6)23(13-26(36)38-8)34(7)27-18(3)21(20-10-11-39-15-20)12-22(27)42-30(28)34/h9-11,15,21-25,28-30H,12-14,16H2,1-8H3
0 references
InChIKey
CJHBVBNPNXOWBA-UHFFFAOYSA-N
0 references
PubChem CID
4482272
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
CJHBVBNPNXOWBA-UHFFFAOYSA-N
UniChem compound ID
48045300
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0257456
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CJHBVBNPNXOWBA-UHFFFAOYSA-N
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