Concept information
Preferred term
انیاتین A2
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C36H63N3O9
inchi
- InChI=1S/C36H63N3O9/c1-16-23(11)26-35(44)47-28(20(5)6)31(40)37(13)25(18-19(3)4)34(43)46-29(21(7)8)32(41)38(14)27(24(12)17-2)36(45)48-30(22(9)10)33(42)39(26)15/h19-30H,16-18H2,1-15H3/t23?,24?,25-,26-,27-,28+,29+,30+/m0/s1
inchikey
- VMUDDRIYPOJBCX-NVNMXTJUSA-N
mass
- 681.912
monoisotopicmass
- 681.45643
smiles
- O=C1O[C@@H](C(=O)N([C@H](C(=O)O[C@@H](C(=O)N([C@H](C(O[C@@H](C(N([C@H]1C(CC)C)C)=O)C(C)C)=O)CC(C)C)C)C(C)C)C(CC)C)C)C(C)C
subset
- 2_STAR
synonym EXACT
- (3S,6R,9S,12R,15S,18R)-3,9-di(butan-2-yl)-4,10,16-trimethyl-15-(2-methylpropyl)-6,12,18-tri(propan-2-yl)-1,7,13-trioxa-4,10,16-triazacyclooctadecane-2,5,8,11,14,17-hexone
In other languages
-
English
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:216436
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