chempirical

Streptogramin

C71H84N10O17CAS 11006-76-11349.51 g/mol

Open in Covalent MOL file
ONONONOONHOOOHNNHONOHONHONOONOOOH
AlcoholAlkeneAmideEsterKetoneLactamLactonePhenol

Properties

Molecular formula
C71H84N10O17
Molar mass
1349.51 g/mol
Exact mass
1348.6016 Da
Melting point
155 °C
logP
3.86Crippen estimate
Polar surface area
363.8 Ų
H-bond donors / acceptors
6 / 19
Rotatable bonds
7
Stereocentres
R, S, S, S, S, R, S, R, S, Rin SMILES atom order
Double bonds
E, E, EE/Z, in SMILES order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
11006-76-1
SMILES
CC[C@@H]1C(=O)N2CCC[C@H]2C(=O)N([C@H](C(=O)N3CCC(=O)C[C@H]3C(=O)N[C@H](C(=O)O[C@@H]([C@@H](C(=O)N1)NC(=O)C4=C(C=CC=N4)O)C)C5=CC=CC=C5)CC6=CC=CC=C6)C.C[C@@H]1/C=C/C(=O)NC/C=C/C(=C/[C@H](CC(=O)CC2=NC(=CO2)C(=O)N3CCC=C3C(=O)O[C@@H]1C(C)C)O)/C
InChIKey
MVTQIFVKRXBCHS-SMMNFGSLSA-N
InChI
InChI=1S/C43H49N7O10.C28H35N3O7/c1-4-29-40(56)49-21-12-17-30(49)41(57)48(3)32(23-26-13-7-5-8-14-26)42(58)50-22-19-28(51)24-31(50)37(53)47-35(27-15-9-6-10-16-27)43(59)60-25(2)34(38(54)45-29)46-39(55)36-33(52)18-11-20-44-36;1-17(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/h5-11,13-16,18,20,25,29-32,34-35,52H,4,12,17,19,21-24H2,1-3H3,(H,45,54)(H,46,55)(H,47,53);5,7-10,13,16-17,19-20,26,32H,6,11-12,14-15H2,1-4H3,(H,29,34)/b;7-5+,10-9+,18-13+/t25-,29-,30+,31+,32+,34+,35+;19-,20-,26-/m11/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

16 names · show all
  • Virginiamycin
  • Mikamycin
  • Virgimycin
  • RP 7293
  • Pyostacine
  • Stapyocine
  • Eskalin V
  • Eskalin 500
  • Stafac 500
  • Pyostacin
  • Stafac 20
  • Stafac
  • Lactrol
  • V-Max
  • Livelong
  • Lactrol XP

Work with Streptogramin

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Didemnin B77327-05-030 % similar Plitidepsin137219-37-530 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook