 Home > Encyclopedia > (2E,4E)-N-[(1S,2R)-2-Hydroxy-1-[[[(3E,5S,8S,10S)-10-hydroxy-5-methyl-2,7-dioxo-1,6-diazacyclododec-3-en-8-yl]amino]carbonyl]propyl]-2,4-dodecadienamide

(2E,4E)-N-[(1S,2R)-2-Hydroxy-1-[[[(3E,5S,8S,10S)-10-hydroxy-5-methyl-2,7-dioxo-1,6-diazacyclododec-3-en-8-yl]amino]carbonyl]propyl]-2,4-dodecadienamide

(2E,4E)-N-[(1S,2R)-2-Hydroxy-1-[[[(3E,5S,8S,10S)-10-hydroxy-5-methyl-2,7-dioxo-1,6-diazacyclododec-3-en-8-yl]amino]carbonyl]propyl]-2,4-dodecadienamide structure

CAS No:
108351-50-4
Formula:
C27H44N4O6
Chemical Name:
(2E,4E)-N-[(1S,2R)-2-Hydroxy-1-[[[(3E,5S,8S,10S)-10-hydroxy-5-methyl-2,7-dioxo-1,6-diazacyclododec-3-en-8-yl]amino]carbonyl]propyl]-2,4-dodecadienamide
Synonyms:
2,4-Dodecadienamide,N-[(1S,2R)-2-hydroxy-1-[[[(3E,5S,8S,10S)-10-hydroxy-5-methyl-2,7-dioxo-1,6-diazacyclododec-3-en-8-yl]amino]carbonyl]propyl]-,(2E,4E)-;2,4-Dodecadienamide,N-[2-hydroxy-1-[[(10-hydroxy-5-methyl-2,7-dioxo-1,6-diazacyclododec-3-en-8-yl)amino]carbonyl]propyl]-,[5S-[3E,5R*,8R*[1R*(2E,4E),2S*],10R*]]-;1,6-Diazacyclododecane,2,4-dodecadienamide deriv.;(2E,4E)-N-[(1S,2R)-2-Hydroxy-1-[[[(3E,5S,8S,10S)-10-hydroxy-5-methyl-2,7-dioxo-1,6-diazacyclododec-3-en-8-yl]amino]carbonyl]propyl]-2,4-dodecadienamide;Antibiotic BU 2867TA;BU 2867TA;Glidobactin A;Cepafungin II;Glidobactin

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(2E,4E)-N-[(1S,2R)-2-Hydroxy-1-[[[(3E,5S,8S,10S)-10-hydroxy-5-methyl-2,7-dioxo-1,6-diazacyclododec-3-en-8-yl]amino]carbonyl]propyl]-2,4-dodecadienamide Basic Attributes

Molecular Weight：

520.66100

Exact Mass：

520.66

Characteristics

PSA：

170.82000

XLogP3：

3.37390

Density：

1.16g/cm3

Boiling Point：

892.9ºC

Flash Point：

493.8ºC

Refractive Index：

1.552

Vapor Pressure：

0mmHg at 25°C

Drug Information

MeSH Entry Terms：

cepafungin II

Computed Properties

Molecular Weight:520.7
XLogP3:3.1
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:12
Exact Mass:520.32608514
Monoisotopic Mass:520.32608514
Topological Polar Surface Area:157
Heavy Atom Count:37
Complexity:826
Defined Atom Stereocenter Count:5
Defined Bond Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (2E,4E)-N-[(1S,2R)-2-Hydroxy-1-[[[(3E,5S,8S,10S)-10-hydroxy-5-methyl-2,7-dioxo-1,6-diazacyclododec-3-en-8-yl]amino]carbonyl]propyl]-2,4-dodecadienamide

Basic Attributes
Characteristics
Drug Information
Computed Properties

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