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Structure

3-[14-(N-Boc-amino)-21,21-dimethyl-13,15,19-trioxo-3,6,9,20-tetraoxa-12,16-diazadocosyloxy]benzoic acid

CAS
1076199-17-1
Catalog Number
ACM1076199171
Category
Other Products
Molecular Weight
641.70708
Molecular Formula
C30H47N3O12

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Specification

Synonyms
3-[14-(N-Boc-amino)-21,21-dimethyl-13,15,19-trioxo-3,6,9,20-tetraoxa-12,16-diazadocosyloxy]benzoic Acid
IUPAC Name
3-[2-[2-[2-[2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]amino]-3-oxopropanoyl]amino]ethoxy]ethoxy]ethoxy]ethoxy]benzoic acid
Canonical SMILES
CC(C)(C)OC(=O)CCNC(=O)C(C(=O)NCCOCCOCCOCCOC1=CC=CC(=C1)C(=O)O)NC(=O)OC(C)(C)C
InChI Key
GXQWMSFJRGMWGC-UHFFFAOYSA-N
Appearance
Clear Oil
Exact Mass
641.31600
H-Bond Acceptor
12
H-Bond Donor
4
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