CAS 54081-68-4 Leurosine Sulfate - Analytical Products / Alfa Chemistry

CAT	APS54081684
CAS	54081-68-4
Molecular Weight	1716.00
Molecular Formula	2C46H56N4O9.H2O4S
Canonical SMILES	CC[C@@]12CN3CCc4c([nH]c5ccccc45)[C@@](C[C@@H](C3)[C@@H]1O2)(C(=O)OC)c6cc7c(cc6OC)N(C)[C@H]8[C@](O)([C@H](OC(=O)C)[C@]9(CC)C=CCN%10CC[C@]78[C@H]9%10)C(=O)OC.CC[C@@]%11%12CN%13CCc%14c([nH]c%15ccccc%14%15)[C@@](C[C@@H](C%13)[C@@H]%11O%12)(C(=O)OC)c%16cc%17c(cc%16OC)N(C)[C@H]%18[C@](O)([C@H](OC(=O)C)[C@]%19(CC)C=CCN%20CC[C@]%17%18[C@H]%19%20)C(=O)OC.OS(=O)(=O)O
InChI	InChI=1S/2C46H56N4O9.H2O4S/c21-8-42-16-12-18-50-20-17-44(37(42)50)30-21-31(34(55-5)22-33(30)48(4)38(44)46(54,41(53)57-7)39(42)58-26(3)51)45(40(52)56-6)23-27-24-49(25-43(9-2)36(27)59-43)19-15-29-28-13-10-11-14-32(28)47-35(29)45;1-5(2,3)4/h210-14,16,21-22,27,36-39,47,54H,8-9,15,17-20,23-25H2,1-7H3;(H2,1,2,3,4)/t2*27-,36+,37-,38+,39+,42+,43-,44+,45-,46-;/m00./s1

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