BU 4794F

Molecular Formula: C₄₅H₅₈O₁₆

InChI: InChI=1/C45H58O16/c1-3-5-7-9-11-13-16-20-30(47)21-17-15-19-23-36(51)59-42-41(33(26-46)61-45(43(42)55)37-29(27-57-45)24-31(48)25-32(37)49)60-44-40(54)39(53)38(52)34(58-44)28-56-35(50)22-18-14-12-10-8-6-4-2/h7-20,22-25,30,33-34,38-44,46-49,52-55H,3-6,21,26-28H2,1-2H3/b9-7+,10-8+,13-11+,14-12+,17-15+,20-16+,22-18+,23-19+/t30?,33u,34u,38-,39-,40+,41?,42-,43+,44-,45-/m0/s1

InChIKey: InChIKey=JSBUKGAJQOVJAQ-QNIRBFHQBU
SMILES: CCCC=CC=CC=CC(CC=CC=CC(=O)OC1C(C(OC2(C1O)C3=C(C=C(C=C3CO2)O)O)CO)OC4C(C(C(C(O4)COC(=O)C=CC=CC=CCCC)O)O)O)O

Names:
    BU 4794F
    BU-4794F
    151013-36-4
    [(3R,3'R,4'R)-5'-[(2S,3R,4S,5R)-6-[[(2E,4E,6E)-deca-2,4,6-trienoyl]oxymethyl]-3,4,5-trihydroxy-oxan-2-yl]oxy-3',4,6-trihydroxy-6'-(hydroxymethyl)spiro[1H-isobenzofuran-3,2'-oxane]-4'-yl] (2E,4E,8E,10E,12E)-7-hydroxyhexadeca-2,4,8,10,12-pentaenoate

Registries:
    PubChem CID 6436281
    PubChem ID 215810