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(2R)-2-azanyl-3-[[(2R,3S,4S)-8-[(2R,3R,4R)-5,7-bis(oxidanyl)-2-[3,4,5-tris(oxidanyl)phenyl]-3-[3,4,5-tris(oxidanyl)phenyl]carbonyloxy-3,4-dihydro-2H-chromen-4-yl]-5,7-bis(oxidanyl)-2-[3,4,5-tris(oxidanyl)phenyl]-3-[3,4,5-tris(oxidanyl)phenyl]carbonyloxy-3,4-dihydro-2H-chromen-4-yl]sulfanyl]propanoic acid
(2R)-2-azanyl-3-[[(2R,3S,4S)-8-[(2R,3R,4R)-5,7-bis(oxidanyl)-2-[3,4,5-tris(oxidanyl)phenyl]-3-[3,4,5-tris(oxidanyl)phenyl]carbonyloxy-3,4-dihydro-2H-chromen-4-yl]-5,7-bis(oxidanyl)-2-[3,4,5-tris(oxidanyl)phenyl]-3-[3,4,5-tris(oxidanyl)phenyl]carbonyloxy-3,4-dihydro-2H-chromen-4-yl]sulfanyl]propanoic acid
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Canonical SMILES:
C1=C(C=C(C(=C1O)O)O)C2C(C(C3=C(C=C(C=C3O2)O)O)C4=C5C(=C(C=C4O)O)C(C(C(O5)C6=CC(=C(C(=C6)O)O)O)OC(=O)C7=CC(=C(C(=C7)O)O)O)SCC(C(=O)O)N)OC(=O)C8=CC(=C(C(=C8)O)O)O
Isomeric SMILES
C1=C(C=C(C(=C1O)O)O)[C@@H]2[C@@H]([C@H](C3=C(C=C(C=C3O2)O)O)C4=C5C(=C(C=C4O)O)[C@@H]([C@H]([C@H](O5)C6=CC(=C(C(=C6)O)O)O)OC(=O)C7=CC(=C(C(=C7)O)O)O)SC[C@@H](C(=O)O)N)OC(=O)C8=CC(=C(C(=C8)O)O)O
InChI
InChI=1S/C47H39NO24S/c48-18(45(65)66)12-73-44-33-21(52)11-20(51)32(41(33)70-40(14-3-24(55)36(62)25(56)4-14)43(44)72-47(68)16-7-28(59)38(64)29(60)8-16)34-31-19(50)9-17(49)10-30(31)69-39(13-1-22(53)35(61)23(54)2-13)42(34)71-46(67)15-5-26(57)37(63)27(58)6-15/h1-11,18,34,39-40,42-44,49-64H,12,48H2,(H,65,66)/t18-,34+,39+,40+,42+,43-,44-/m0/s1
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