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(Q104199617)
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English
VNGGJOJJOWAMMM-UHFFFAOYSA-N
group of stereoisomers with the chemical formula C₃₄H₄₀N₆O₈S₄
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Statements
instance of
group of stereoisomers
0 references
subclass of
chaetocin-like alkaloid
1 reference
inferred from
chaetocin-like alkaloid
biogenic 2,5-diketopiperazine
1 reference
inferred from
biogenic 2,5-diketopiperazine
mass
788.1790462400004
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₃₄H₄₀N₆O₈S₄
0 references
canonical SMILES
O=C1N(C)C(SC)(C(=O)N2C3NC=4C=CC=CC4C3(C(O)C12SC)C56C=7C=CC=CC7NC6N8C(=O)C(SC)(N(C(=O)C8(SC)C5O)C)CO)CO
0 references
Identifiers
InChI
InChI=1S/C34H40N6O8S4/c1-37-27(47)33(51-5)21(43)31(17-11-7-9-13-19(17)35-23(31)39(33)25(45)29(37,15-41)49-3)32-18-12-8-10-14-20(18)36-24(32)40-26(46)30(16-42,50-4)38(2)28(48)34(40,52-6)22(32)44/h7-14,21-24,35-36,41-44H,15-16H2,1-6H3
0 references
InChIKey
VNGGJOJJOWAMMM-UHFFFAOYSA-N
0 references
PubChem CID
72500983
1 reference
matched by identifier from
InChIKey
InChIKey
VNGGJOJJOWAMMM-UHFFFAOYSA-N
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