OPTIMAX

CAS No.
62602-94-2
CCD No.
CCD00244511
Formula
C11 H12 N2 O2 . C8 H11 N O3 . C6 H8 O6 . Cl H
MolWeight
585.991

Basic Information

Product Name: OPTIMAX
CAS: 62602-94-2
English Synonyms: OPTIMAX
MDL Number.: MFCD01710998
H bond acceptor: 4
H bond donor: 3
Smile: Cc1c(c(c(cn1)CO)CO)O.c1ccc2c(c1)c(c[nH]2)C[C@H](C(=O)O)N.C([C@@H]([C@@H]1C(=C(C(=O)O1)O)O)O)O.Cl
InChi: InChI=1S/C11H12N2O2.C8H11NO3.C6H8O6.ClH/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10;1-5-8(12)7(4-11)6(3-10)2-9-5;7-1-2(8)5-3(9)4(10)6(11)12-5;/h1-4,6,9,13H,5,12H2,(H,14,15);2,10-12H,3-4H2,1H3;2,5,7-10H,1H2;1H/t9-;;2-,5+;/m1.0./s1
InChiKey: InChIKey=YJUMYXNABUVVNF-YPWZGCCVSA-N

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