16545-11-2
GUAMECYCLINE
Name
GUAMECYCLINE
Formula
C29 H38 N8 O8
MolWeight
626.667
1Identification
【Name】
GUAMECYCLINE
【CAS】
【MDL】
MFCD01747634
【English Synonyms】
【Formula】
C29 H38 N8 O8
【MolWeight】
626.667
【Inchi】
InChI=1S/C29H38N8O8/c1-28(44)13-5-4-6-16(38)17(13)21(39)18-14(28)11-15-20(35(2)3)22(40)19(24(42)29(15,45)23(18)41)25(43)33-12-36-7-9-37(10-8-36)27(32)34-26(30)31/h4-6,14-15,20,38,40-41,44-45H,7-12H2,1-3H3,(H,33,43)(H5,30,31,32,34)/t14-,15-,20-,28+,29-/m0/s1
【InChIKey】
InChIKey=DIRJDIBCAHCCFL-AQFAATAFSA-N
【SMILES】
C[C@]1(c2cccc(c2C(=O)C3=C([C@]4([C@@H](C[C@@H]31)[C@@H](C(=C(C4=O)C(=O)NCN5CCN(CC5)C(=N)NC(=N)N)O)N(C)C)O)O)O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:10
H bond acceptor:16
XLogP3:-13.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
GUAMECYCLINE.cml
Quick Release
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