2-acetamido-5-[formyl(hydroxy)amino]-N-[1-[3-[5-[3-[formyl(hydroxy)amino]propyl]-3,6-dioxopiperazin-2-yl]propyl-hydroxyamino]-3-hydroxy-1-oxopropan-2-yl]pentanamide

HCID 3412
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Basic information

Standard SMILES
CC(=O)NC(CCCN(O)C=O)C(=O)NC(CO)C(=O)N(O)CCCC1NC(=O)C(CCCN(O)C=O)NC1=O
InChIKey
IQMHGRIOYXVPSE-UHFFFAOYSA-N
Molecular formula
C22H37N7O11
Average molar mass
575.6 g/mol
Monoisotopic mass
575.25510502

Names & identifiers

Preferred name
2-acetamido-5-[formyl(hydroxy)amino]-N-[1-[3-[5-[3-[formyl(hydroxy)amino]propyl]-3,6-dioxopiperazin-2-yl]propyl-hydroxyamino]-3-hydroxy-1-oxopropan-2-yl]pentanamide
IUPAC
2-acetamido-5-[formyl(hydroxy)amino]-N-[1-[3-[5-[3-[formyl(hydroxy)amino]propyl]-3,6-dioxopiperazin-2-yl]propyl-hydroxyamino]-3-hydroxy-1-oxopropan-2-yl]pentanamide

Names & synonyms

NSC612475NSC-6124752, 3-[3-[N-[N-(N(sup.alpha.)-acetyl-N(sup.gamma.)-formyl- N(sup.gamma.)-hydroxy-L-ornithyl)-L-seryl]-N-(hydroxy) amino]propyl]-6-[3-(N-formyl-N-hydroxyamino)propyl]-, (3S,6S)

Database identifiers

PubChem CID
3412

Properties

Computed structural properties

XLogP
-4
Topological polar surface area
258 Ų
Hydrogen bond donors
8
Hydrogen bond acceptors
11
Rotatable bonds
17
Heavy atoms
40

Related reactions

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