Chitinovorin A
[CAS# 95041-98-8]

Identification

• Name: Chitinovorin A
• Synonyms: 7-[(5-Amino-6-Hydroxy-6-Oxo-Hexanoyl)Amino]-3-[[4-(2-Aminopropanoylamino)-7-Guanidino-3-Hydroxy-Heptanoyl]Oxymethyl]-7-Formamido-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylic Acid; 7-[(5-Amino-6-Hydroxy-1,6-Dioxohexyl)Amino]-3-[[4-[(2-Amino-1-Oxop
• Molecular Formula: C₂₆H₄₁N₉O₁₁S
• Molecular Weight: 687.72
• CAS Registry Number: 95041-98-8
• SMILES: C(OC(=O)CC(O)C(NC(=O)C(N)C)CCCN=C(N)N)C1=C(N2C(SC1)C(NC(=O)CCCC(N)C(O)=O)(NC=O)C2=O)C(O)=O
• InChI: 1S/C26H41N9O11S/c1-12(27)20(40)33-15(5-3-7-31-25(29)30)16(37)8-18(39)46-9-13-10-47-24-26(32-11-36,23(45)35(24)19(13)22(43)44)34-17(38)6-2-4-14(28)21(41)42/h11-12,14-16,24,37H,2-10,27-28H2,1H3,(H,32,36)(H,33,40)(H,34,38)(H,41,42)(H,43,44)(H4,29,30,31)
• InChIKey: QIKMSWPGMFAWFV-UHFFFAOYSA-N