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Chemical structure of Oleanolic aldehyde

GC76283

Oleanolic aldehyde

Also known as (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carbaldehyde

Oleanolic aldehyde is an antimicrobial compound used to inhibit oral bacteria

ChemicalCAS17020-22-3MW440.7FormulaC30H48O2
CAS number
17020-22-3
Molecular weight
440.7
Formula
C30H48O2
Solubility
DMSO： 10 mg/mL (22·69 mM; ultrasonic and warming and heat to 60°C)
InChIKey
STHRNDDZYFUIDO-OSQDELBUSA-N
Catalogue number
GC76283
Brand
GLPBIO
Computed properties PubChem CID 10321055 · XLogP 7.4 · TPSA 37.3 Ų · H-bond donors 1
XLogP
7.4
TPSA
37.3 Ų
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
32

SMILES C[C@]12CC[C@@H](C([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C=O)C)C)(C)C)O

Computed descriptors from PubChem (CID 10321055), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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