Structure

Enterobactin

CAS
28384-96-5
Catalog Number
ACM28384965
Category
Other Products
Molecular Weight
669.55
Molecular Formula
C30H27N3O15

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Specification

Synonyms
N-[(3S,7S,11S)-7,11-bis[(2,3-dihydroxybenzoyl)amino]-2,6,10-trioxo-1,5,9-trioxacyclododec-3-yl]-2,3-dihydroxybenzamide; Enterobactin;
IUPAC Name
N-[(3S,7S,11S)-7,11-bis[(2,3-dihydroxybenzoyl)amino]-2,6,10-trioxo-1,5,9-trioxacyclododec-3-yl]-2,3-dihydroxybenzamide
Canonical SMILES
C1C(C(=O)OCC(C(=O)OCC(C(=O)O1)NC(=O)C2=C(C(=CC=C2)O)O)NC(=O)C3=C(C(=CC=C3)O)O)NC(=O)C4=C(C(=CC=C4)O)O
InChI Key
SERBHKJMVBATSJ-BZSNNMDCSA-N
Boiling Point
1109.1ºC at 760 mmHg
Flash Point
624.6ºC
Density
1.72g/cm³
Exact Mass
669.14400
H-Bond Acceptor
15
H-Bond Donor
9
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