Juglomycin Z
Basic information
- CAS
160162-39-0- Standard SMILES
CC1=C(C[C@H](O)CC(=O)O)C(=O)c2cccc(O)c2C1=O- InChIKey
MIJQQLCPVSCPSU-QMMMGPOBSA-N- Molecular formula
- C15H14O6
- Average molar mass
- 290.27 g/mol
- Monoisotopic mass
- 290.07903816
Overview
Juglomycin Z is a naphthoquinone.
Names & identifiers
- Preferred name
- Juglomycin Z
- IUPAC
- (3S)-3-hydroxy-4-(5-hydroxy-3-methyl-1,4-dioxonaphthalen-2-yl)butanoic acid
- English name
- juglomycin Z
- Molecular formula
- C15H14O6
- Molecular weight
- 290.27
Names & synonyms
Juglomycin Z160162-39-0(3S)-3-hydroxy-4-(5-hydroxy-3-methyl-1,4-dioxonaphthalen-2-yl)butanoic acid2-Naphthalenebutanoic acid, 1,4-dihydro-beta,5-dihydroxy-3-methyl-1,4-dioxo-, (S)-RefChem:150600(3s)-3-hydroxy-4-(5-hydroxy-3-methyl-1,4-dioxo-1,4-dihydronaphthalen-2-yl)butanoic acidSCHEMBL29885562DTXSID40936233CHEBI:2051503-Hydroxy-4-(5-hydroxy-3-methyl-1,4-dioxo-1,4-dihydronaphthalen-2-yl)butanoic acid2-Naphthalenebutanoic acid, 1,4-dihydro-β,5-dihydroxy-3-methyl-1,4-dioxo-, (βS)-
Database identifiers
- CAS
160162-39-0- PubChem CID
- 190948
- DTXSID
DTXSID40936233- ChEBI
CHEBI:205150- Nikkaji
- J608.150I
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 506
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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