canSAR945291
FEATURES
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NAMES
    SMILES
    O=S(=O)(O)OCCCCOC[C@H]1O[C@@H]2O[C@@H]3[C@@H](COCCCCOS(=O)(=O)O)O[C@H](O[C@@H]4[C@@H](COCCCCOS(=O)(=O)O)O[C@H](O[C@@H]5[C@@H](COCCCCOS(=O)(=O)O)O[C@H](O[C@@H]6[C@@H](COCCCCOS(=O)(=O)O)O[C@H](O[C@@H]7[C@@H](COCCCCOS(=O)(=O)O)O[C@H](O[C@@H]8[C@@H](COCCCCOS(=O)(=O)O)O[C@H](O[C@H]1[C@H](O)[C@H]2O)[C@H](O)[C@H]8O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O
    InChI
    InChI=1S/C70H126O63S7/c71-43-50(78)64-120-36(29-106-15-1-8-22-113-134(85,86)87)57(43)127-65-51(79)44(72)59(38(121-65)31-108-17-3-10-24-115-136(91,92)93)129-67-53(81)46(74)61(40(123-67)33-110-19-5-12-26-117-138(97,98)99)131-69-55(83)48(76)63(42(125-69)35-112-21-7-14-28-119-140(103,104)105)133-70-56(84)49(77)62(41(126-70)34-111-20-6-13-27-118-139(100,101)102)132-68-54(82)47(75)60(39(124-68)32-109-18-4-11-25-116-137(94,95)96)130-66-52(80)45(73)58(128-64)37(122-66)30-107-16-2-9-23-114-135(88,89)90/h36-84H,1-35H2,(H,85,86,87)(H,88,89,90)(H,91,92,93)(H,94,95,96)(H,97,98,99)(H,100,101,102)(H,103,104,105)/t36-,37-,38-,39-,40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-/m1/s1
    MOLECULAR FORMULA
    C70H126O63S7
    CROSS REFERENCES
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    canSAR945291
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight2198.47
    AlogP-10.86
    HBond donors21
    HBond acceptors63
    Atoms266
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR945291.