Vinleucinol

Molecular Formula: C₅₁H₆₉N₅O₉

InChI: InChI=1/C51H69N5O9/c1-9-30(5)39(41(57)65-12-4)53-45(59)51(62)43-49(20-23-56-21-15-19-48(11-3,42(49)56)44(51)58)34-24-35(38(63-7)25-37(34)54(43)6)50(46(60)64-8)27-31-26-47(61,10-2)29-55(28-31)22-18-33-32-16-13-14-17-36(32)52-40(33)50/h13-17,19,24-25,30-31,39,42-44,52,58,61-62H,9-12,18,20-23,26-29H2,1-8H3,(H,53,59)/t30-,31+,39-,42-,43+,44+,47-,48+,49+,50-,51-/m0/s1/f/h53H

InChIKey: InChIKey=QSTPFUDHVVIGCL-YSRORMIEDO
SMILES: CCC(C)C(C(=O)OCC)NC(=O)C1(C2C3(CCN4C3C(C1O)(C=CC4)CC)C5=CC(=C(C=C5N2C)OC)C6(CC7CC(CN(C7)CCC8=C6NC9=CC=CC=C89)(CC)O)C(=O)OC)O

Names:
    Ethyl N-(O-4-deacetylvinblasin-23-oyl)-L-isoleucinate
    VILE
    Vincaleukoblastine, O(sup 4)-deacetyl-3-de(methoxycarbonyl)-3-(((1-(ethoxycarbonyl)-2-methylbutyl)amino)carbonyl)-, (3(1S,2S))-
    Vinleucinolum [INN-Latin]
    Vinleucinol [INN]
    Vinleucinol
    (23(1S,2S))-4-Deacetyl-3-((1-carboxy-2-methylbutyl)carbamoyl)-3-de(methoxycarbonyl)vincaleukoblastine, ethyl ester
    81571-28-0

Registries:
    PubChem CID 72163
    PubChem ID 214423