Escin, monosodium salt,20977-05-3-Amadis Chemical

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[CAS No.20977-05-3] A879320 Escin, monosodium salt 97%

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Product Details [20977-05-3]

CAS Number: 20977-05-3

MDL No.: MFCD01772116

Catalog Number: A879320

EINECS:

Molecular Formula: C₅₄H₈₄NaO₂₃

Molecular Weight: 1,124.22

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Appearance: Powder

Storage: Store in 2-8°C for long term (months)

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Smiles: [Na+].O1[C@]2(C3(C(O[H])([H])[C@@]1(C(C(C3(C1[C@](C2([H])[H])(C([H])([H])[H])C2(C([H])([H])[H])C(C3(C(C(C2([H])[H])([H])[H])([H])[C@](C(O[H])([H])[H])(C([H])([H])[H])C(O[C@@]2(O[C@@](C(O[H])=O)([H])[C@](O[C@]4(O[C@@](C(O[H])([H])[H])([H])[C@](O[H])([H])[C@@](O[H])([H])[C@]4(O[H])[H])[H])([H])[C@@](O[H])([H])[C@]2(O[C@@]2(OC([H])([H])[C@](O[H])([H])[C@@](O[H])([H])[C@]2(O[H])[H])[H])[H])[H])([H])C([H])([H])C3([H])[H])C([H])([H])[H])([H])C([H])([H])C=1[H])[H])([H])[H])(C([H])([H])[H])C([H])([H])[H])[H])C(OC(=O)C(C(OC(=O)C([H])([H])[H])(C([H])([H])[H])[H])(C([H])([H])[H])[H])([H])[H])[H]

InchiKey: OJTQULAMLNBGOY-RRKCPRGASA-N

Inchi: InChI=1S/C54H84O23.Na/c1-22(23(2)71-24(3)57)45(68)70-21-54-26-16-49(4,5)43(42(54)65)73-32(54)17-53(9)25(26)10-11-30-50(6)14-13-31(51(7,20-56)29(50)12-15-52(30,53)8)74-48-40(76-46-36(62)33(59)27(58)19-69-46)38(64)39(41(77-48)44(66)67)75-47-37(63)35(61)34(60)28(18-55)72-47;/h10,22-23,26-43,46-48,55-56,58-65H,11-21H2,1-9H3,(H,66,67);/q;+1/t22?,23?,26?,27-,28-,29?,30?,31?,32-,33+,34-,35+,36-,37-,38+,39+,40-,41+,42?,43-,46+,47-,48-,50?,51-,52?,53-,54?;/m1./s1

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