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Chemical structure of MMB-FUBICA metabolite 3

GC44232

MMB-FUBICA metabolite 3

Also known as (2S)-2-[[1-[(4-fluorophenyl)methyl]indole-3-carbonyl]amino]-3-methylbutanoic acid

MMB-FUBICA metabolite 3 is an analytical reference standard that is structurally similar to known synthetic cannabinoids

ChemicalCAS2693397-44-1MW368.4FormulaC21H21FN2O3
CAS number
2693397-44-1
Molecular weight
368.4
Formula
C21H21FN2O3
Solubility
DMF： 30 mg/ml,DMSO： 30 mg/ml,Ethanol： 30 mg/ml,PBS (pH 7·2)： 0·1 mg/ml
InChIKey
GLSZASCWFBSHNV-IBGZPJMESA-N
Catalogue number
GC44232
Brand
GLPBIO
Computed properties PubChem CID 137700397 · XLogP 3.9 · TPSA 71.3 Ų · H-bond donors 2
XLogP
3.9
TPSA
71.3 Ų
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
27

SMILES CC(C)[C@@H](C(=O)O)NC(=O)C1=CN(C2=CC=CC=C21)CC3=CC=C(C=C3)F

Computed descriptors from PubChem (CID 137700397), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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