Systematic / IUPAC Name: (10R,11R,12E,17E,19E,21S)-21-Hydroxy-10-isopropyl-11,19-dimethyl-9,26-dioxa-3,15,28-triazatricyclo[23.2.1.03,7]octacosa-1(27),6,12,17,19,25(28)-hexaene-2,8,14,23-tetrone
ID: Reference9962
Other Names:
Mikamycin A;
Ostreogrycin a;
Pristinamycin iia;
Streptogramin A;
Vernamycin A
; more
Formula: C28H35N3O7
Virginiamycin mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
No. of Spectral Trees | 1 |
No. of Spectra | 2855 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 9/28/2020 11:38:45 AM |
InChI | InChI=1S/C28H35N3O7/c1-17(2)26-19(4)9-10-24(34)29-11-5-7-18(3)13-20(32)14-21(33)15-25-30-22(16-37-25)27(35)31-12-6-8-23(31)28(36)38-26/h5,7-10,13,16-17,19-20,26,32H,6,11-12,14-15H2,1-4H3,(H,29,34)/b7-5+,10-9+,18-13+/t19-,20-,26-/m1/s1 |
InChI Key | DAIKHDNSXMZDCU-FQTGFAPKSA-N |
Canonical SMILES | CC1C=CC(=O)NCC=CC(=CC(CC(=O)CC2=NC(=CO2)C(=O)N3CCC=C3C(=O)OC1C(C)C)O)C |
CAS | |
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Other Names |
Mikamycin A; Ostreogrycin a; Pristinamycin iia; Streptogramin A; Vernamycin A; Virginiamycin factor m1; Virginiamycin m1; (3R,4R,5E,10E,12E,14S)-14-Hydroxy-3-isopropyl-4,12-dimethyl-8,9,14,15,24,25-hexahydro-1H,3H,22H-21,18-(azeno)pyrrolo[2,1-c][1,8,4,19]dioxadiazacyclotetracosine-1,7,16,22(4H,17H)-tetrone |
Wikipedia | Pristinamycin_IIA |
DrugBank | DB01669 |
ChEMBL | CHEMBL1236670 |
KEGG | C11299 |
PubChem | 5459319 |
ChEBI | CHEBI:9997 |
ChemSpider | 10222381 |