Structure

Efegatran

CAS
105806-65-3
Catalog Number
ACM105806653
Category
Other Products
Molecular Weight
416.517180 [g/mol]
Molecular Formula
C21H32N6O3

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Specification

IUPAC Name
(2S)-N-[(2S)-5-(diaminomethylideneamino)-1-oxopentan-2-yl]-1-[(2R)-2-(methylamino)-3-phenylpropanoyl]pyrrolidine-2-carboxamide
Canonical SMILES
CNC(CC1=CC=CC=C1)C(=O)N2CCCC2C(=O)NC(CCCN=C(N)N)C=O
InChI Key
KAGLWQUWUNBAOO-KSZLIROESA-N
Density
1.29g/cm³
Exact Mass
416.25400
H-Bond Acceptor
7
H-Bond Donor
4
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