BGC > Produktsuche > Micafungin FR-179642 | 168110-44-9

Molecular Formula: C35H52N8O20S
Molecular Weight: 936.89398

Description:
FR 179642 is an impurity of Micafungin, which is an antifungal agent.

• Molecular Weight:936.89
• Melting Point:>150°C (dec.)
• Purity:≥95%

Molecular Formula:
C35H52N8O20S
Canonical SMILES:
CC1CN2C(C1O)C(=O)NC(C(CC(C(=O)NC(C(=O)N3CC(CC3C(=O)NC(C(=O)NC(C2=O)C(CC(=O)N)O)C(C(C4=CC(=C(C=C4)O)OS(=O)(=O)O)O)O)O)C(C)O)N)O)O
InChI:
InChI=1S/C35H52N8O20S/c1-11-9-43-25(26(11)50)33(57)41-31(55)19(48)7-15(36)29(53)38-22(12(2)44)34(58)42-10-14(45)6-16(42)30(54)40-24(32(56)39-23(35(43)59)18(47)8-21(37)49)28(52)27(51)13-3-4-17(46)20(5-13)63-64(60,61)62/h3-5,11-12,14-16,18-19,22-28,31,44-48,50-52,55H,6-10,36H2,1-2H3,(H2,37,49)(H,38,53)(H,39,56)(H,40,54)(H,41,57)(H,60,61,62)/t11-,12+,14+,15-,16-,18+,19+,22-,23-,24-,25-,26-,27-,28-,31+/m0/s1
InChIKey:
QCYMOOBOFFUBHZ-CPYYHODSSA-N
Solubility:
Soluble in DMSO (Slightly, Heated), Methanol (Slightly, Heated, Sonicated)
Appearance:
White to Off-white Solid
Storage: Store at -20°C under inert atmosphere
Synonyms:
FR-179642; FR179642; Pneumocandin M1; 1-[(4R,5R)-4,5-Dihydroxy-L-ornithine]-4-[(4S)-4-hydroxy-4-[4-hydroxy-3-(sulfooxy)phenyl]-L-threonine]pneumocandin A0; 1-[(4R,5R)-4,5-Dihydroxy-L-ornithine]-4-[(S)-4-hydroxy-4-[4-hydroxy-3-(sulfooxy)phenyl]-L-threonine]pneumocandin A0; CMICA; FR 133303