Basic information
- CAS
65357-64-4- Standard SMILES
C=Cc1cc(OC)c2c(c1)c(=O)oc1c2cc(OC)c2c(O)ccc([C@H]3O[C@H](C)[C@H](O)[C@H](O)[C@H]3O)c21- InChIKey
MSXWAMODDZJPTG-QGZLGSDISA-N- Molecular formula
- C27H26O9
- Average molar mass
- 494.5 g/mol
- Monoisotopic mass
- 494.1576824
Overview
Toromycin has been reported in Streptomyces with data available.
Names & identifiers
- Preferred name
- Toromycin
- IUPAC
- 8-ethenyl-1-hydroxy-10,12-dimethoxy-4-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]naphtho[1,2-c]isochromen-6-one
- English name
- toromycin
- Molecular weight
- 0
Names & synonyms
TOROMYCINAntibiotic B21085Antibiotic B-2108565357-64-4RefChem:1904528-ethenyl-1-hydroxy-10,12-dimethoxy-4-((2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl)naphtho(1,2-c)isochromen-6-oneAntibiotic B 21085B21085CHEMBL520073SCHEMBL29351409SCHEMBL29885453DTXSID10983976
Show more names
(1R)-1,5-Anhydro-6-deoxy-1-(8-ethenyl-1-hydroxy-10,12-dimethoxy-6-oxo-6H-benzo[d]naphtho[1,2-b]pyran-4-yl)-D-galactitol1,5-Anhydro-6-deoxy-1-(8-ethenyl-1-hydroxy-10,12-dimethoxy-6-oxo-6H-benzo[d]naphtho[1,2-b]pyran-4-yl)hexitol
Database identifiers
- CAS
65357-64-4、77879-90-4- PubChem CID
- 53802
- DTXSID
DTXSID10983976- ChEMBL
CHEMBL520073
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 135 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 4
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 821
Physicochemical properties
- EWG's Food Scores
- 1 · 1
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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