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Chemical structure of Methyl dehydroabietate

GC76955

Methyl dehydroabietate

Also known as methyl (1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate

Methyl dehydroabietate is a kind of resin acid that can be isolated from spruce bark

ChemicalCAS1235-74-1MW314.46FormulaC21H30O2
CAS number
1235-74-1
Molecular weight
314.46
Formula
C21H30O2
Solubility
DMSO： 50 mg/mL (159·00 mM; Need ultrasonic)
InChIKey
PGZCJOPTDHWYES-HMXCVIKNSA-N
Catalogue number
GC76955
Brand
GLPBIO
Computed properties PubChem CID 14697 · XLogP 5.9 · TPSA 26.3 Ų · H-bond donors 0
XLogP
5.9
TPSA
26.3 Ų
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
23

SMILES CC(C)C1=CC2=C(C=C1)[C@]3(CCC[C@@]([C@@H]3CC2)(C)C(=O)OC)C

Computed descriptors from PubChem (CID 14697), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Documents
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