NYSTATIN DIHYDRATE

CAS No.
CCD No.
CCD00074860
Formula
C47 H75 N O17 . 2 H2 O
MolWeight
962.129

Basic Information

Product Name: NYSTATIN DIHYDRATE
English Synonyms: NYSTATIN DIHYDRATE
MDL Number.: MFCD00150826
H bond acceptor: 18
H bond donor: 12
Smile: CC1/C=C/C=C/CC/C=C/C=C/C=C/C=C/C(CC2C(C(CC(O2)(CC(C(CCC(CC(CC(CC(=O)OC(C(C1O)C)C)O)O)O)O)O)O)O)C(=O)O)O[C@H]3[C@H]([C@H]([C@@H]([C@H](O3)C)O)N)O.O.O
InChi: InChI=1S/C47H75NO17.2H2O/c1-27-17-15-13-11-9-7-5-6-8-10-12-14-16-18-34(64-46-44(58)41(48)43(57)30(4)63-46)24-38-40(45(59)60)37(54)26-47(61,65-38)25-36(53)35(52)20-19-31(49)21-32(50)22-33(51)23-39(55)62-29(3)28(2)42(27)56;;/h5-6,8,10-18,27-38,40-44,46,49-54,56-58,61H,7,9,19-26,48H2,1-4H3,(H,59,60);2*1H2/b6-5+,10-8+,13-11+,14-12+,17-15+,18-16+;;/t27?,28?,29?,30-,31?,32?,33?,34?,35?,36?,37?,38?,40?,41+,42?,43-,44+,46+,47?;;/m1../s1
InChiKey: InChIKey=VXWFKTGGEJLHPP-OQMKPJEFSA-N

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