Molecule:100799: Difference between revisions
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molecule
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{{ | {{MoleculeCollection | ||
|trivialname= | |trivialname= | ||
|abbrev= | |abbrev= | ||
| Line 6: | Line 6: | ||
|synonyms= | |synonyms= | ||
|hasVendors= | |hasVendors= | ||
|moleculeKey= | |moleculeKey=N123CCS4CC5C=C(CN6[Co+2]78N9CC%10C=C(C=CC=%10)CS([*]14S(CC1C=CC=C(CN7CCN8(CC6)CC9)C=1)CC2)CC3)C=CC=5r1 | ||
|molOrRxn= | |molOrRxn= | ||
-INDIGO- | -INDIGO-02272416142D | ||
0 0 0 0 0 0 0 0 0 0 0 V3000 | 0 0 0 0 0 0 0 0 0 0 0 V3000 | ||
| Line 18: | Line 18: | ||
M V30 3 C 3.4 -7.65705 0.0 0 | M V30 3 C 3.4 -7.65705 0.0 0 | ||
M V30 4 S 4.4 -7.65705 0.0 0 | M V30 4 S 4.4 -7.65705 0.0 0 | ||
M V30 5 | M V30 5 R# 4.84093 -5.41618 0.0 0 RGROUPS=(1 1) | ||
M V30 6 C 2.53397 -6.425 0.0 0 | M V30 6 C 2.53397 -6.425 0.0 0 | ||
M V30 7 C 2.9 -5.05897 0.0 0 | M V30 7 C 2.9 -5.05897 0.0 0 | ||
| Line 124: | Line 124: | ||
M V30 END CTAB | M V30 END CTAB | ||
M END | M END | ||
|smiles=N123CCS4CC5C=C(CN6[Co+2]78N9CC%10C=C(C=CC=%10)CS([ | |||
|inchi= | |smiles=N123CCS4CC5C=C(CN6[Co+2]78N9CC%10C=C(C=CC=%10)CS([*]14S(CC1C=CC=C(CN7CCN8(CC6)CC9)C=1)CC2)CC3)C=CC=5 | ||
|inchikey= | |inchi= | ||
|inchikey= | |||
|width=300px | |width=300px | ||
|height=200px | |height=200px | ||
Revision as of 16:55, 27 February 2024
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R-Groups
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Molecule is used on following pages
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