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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H21NO5
Molecular Weight 367.3951
Optical Activity ( + )
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CORYNOLINE

SMILES

CN1CC2=C3OCOC3=CC=C2[C@@]4(C)[C@@H](O)CC5=CC6=C(OCO6)C=C5[C@@H]14

InChI

InChIKey=IQUGPRHKZNCHGC-TYPHKJRUSA-N
InChI=1S/C21H21NO5/c1-21-14-3-4-15-19(27-10-24-15)13(14)8-22(2)20(21)12-7-17-16(25-9-26-17)5-11(12)6-18(21)23/h3-5,7,18,20,23H,6,8-10H2,1-2H3/t18-,20+,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H21NO5
Molecular Weight 367.3951
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Targets

Primary TargetPharmacologyConditionPotency
72.4 µM [IC50]

PubMed

Substance Class Chemical
Record UNII
ZQ9W3JU6N3
Record Status Validated (UNII)
Record Version