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(Q104199105)
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English
6-benzyl-8,10-dihydroxy-12-(7-hydroxyoctan-2-yl)-4,9-dimethyl-3-(2-methylpropyl)-1-oxa-4,7-diazacyclododec-7-ene-2,5-dione
group of stereoisomers with the chemical formula C₃₀H₄₈N₂O₆
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Statements
instance of
group of stereoisomers
0 references
subclass of
biogenic cyclopeptide
1 reference
inferred from
biogenic cyclopeptide
mass
532.3512372559999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₃₀H₄₈N₂O₆
0 references
canonical SMILES
CC(C)CC1C(=O)OC(C(C)CCCCC(C)O)CC(O)C(C)C(=O)NC(Cc2ccccc2)C(=O)N1C
0 references
Identifiers
InChI
InChI=1S/C30H48N2O6/c1-19(2)16-25-30(37)38-27(20(3)12-10-11-13-21(4)33)18-26(34)22(5)28(35)31-24(29(36)32(25)6)17-23-14-8-7-9-15-23/h7-9,14-15,19-22,24-27,33-34H,10-13,16-18H2,1-6H3,(H,31,35)
0 references
InChIKey
UZCOJEWMPWMEGB-UHFFFAOYSA-N
0 references
PubChem CID
162814275
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
UZCOJEWMPWMEGB-UHFFFAOYSA-N
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