Bis(N-Ethylidene Vindesine)Disulfide
[CAS# 66759-69-1]

Identification

• Name: Bis(N-Ethylidene Vindesine)Disulfide
• Synonyms: Bis(N-Ethylidene Vindesine)Disulfide, Disulfate; Bis-Vds; Vincaleukoblastine, 3,3''-(Dithiobis(2,1-Ethanediyliminocarbonyl))Bis(O4-Deacetyl-3-De(Methoxycarbonyl)-
• Molecular Formula: C₉₀H₁₁₆N₁₀O₁₄S₂
• Molecular Weight: 1626.09
• CAS Registry Number: 66759-69-1
• SMILES: C2=C1C78C(N(C1=CC(=C2C5(C4=C(C3=CC=CC=C3[NH]4)CCN6CC(C5)CC(O)(C6)CC)C(OC)=O)OC)C)C(O)(C(O)C9(C7N(CC8)CC=C9)CC)C(=O)NCCSSCCNC(=O)C%14(O)C%11N(C%10=CC(=C(C=C%10C%11%12C%13N(CC%12)CC=CC%13(C%14O)CC)C%17(C%16=C(C%15=CC=CC=C%15[NH]%16)CCN%18CC(C%17)CC(O)(C%18)CC)C(OC)=O)OC)C
• InChI: 1S/C90H116N10O14S2/c1-11-81(107)45-53-47-87(79(105)113-9,69-57(25-35-97(49-53)51-81)55-21-15-17-23-63(55)93-69)61-41-59-65(43-67(61)111-7)95(5)73-85(59)29-37-99-33-19-27-83(13-3,71(85)99)75(101)89(73,109)77(103)91-31-39-115-116-40-32-92-78(104)90(110)74-86(30-38-100-34-20-28-84(14-4,72(86)100)76(90)102)60-42-62(68(112-8)44-66(60)96(74)6)88(80(106)114-10)48-54-46-82(108,12-2)52-98(50-54)36-26-58-56-22-16-18-24-64(56)94-70(58)88/h15-24,27-28,41-44,53-54,71-76,93-94,101-102,107-110H,11-14,25-26,29-40,45-52H2,1-10H3,(H,91,103)(H,92,104)
• InChIKey: VSRQTVODHBWBAZ-UHFFFAOYSA-N

Properties

• Density: 1.45g/cm³ (Cal.)