CAS
108065-95-8 Purity
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108065-95-8 Purity
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Abbeymycin
CAS
108073-64-9
Catalog Number
ACM108073649
Category
Other Products
Molecular Weight
248.277740 [g/mol]
Molecular Formula
C13H16N2O3
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Specification
Synonyms
Abbeymycin, 5H-Pyrrolo(2,1-c)(1,4)benzodiazepin-5-one, 1,2,3,10,11,11a-hexahydro-2-hydroxy-11-methoxy-, (2S-(2-alpha,11-beta,11a-beta))-, AC1L41WL, LS-139265, (6S,6aS,8S)-8-hydroxy-6-methoxy-5,6,6a,7,8,9-hexahydropyrrolo[2,1-c][1,4]benzodiazepin-11-one, 108073-64-9
IUPAC Name
(6S,6aS,8S)-8-hydroxy-6-methoxy-5,6,6a,7,8,9-hexahydropyrrolo[2,1-c][1,4]benzodiazepin-11-one
Canonical SMILES
COC1C2CC(CN2C(=O)C3=CC=CC=C3N1)O
InChI Key
SSMFXCDUJJPFBJ-UWJYBYFXSA-N
Boiling Point
477.5ºC at 760 mmHg
Flash Point
242.6ºC
Density
1.35g/cm³
Exact Mass
248.11600
H-Bond Acceptor
4
H-Bond Donor
2
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