dihydroergocornine mesylate Report issue

Small molecule Experimental
Drug Central MeSH PubChem

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Chemistry

Mol. Mass

563.6877

ALogP

Missing data

Rule of 5

Missing data

Rule of 3

Missing data
Details
  • SMILES: CC(C)[C@@H]1N2C(=O)[C@](NC(=O)[C@@H]3C[C@H]4[C@@H](CC5=CNC6=C5C4=CC=C6)N(C)C3)(O[C@@]2(O)[C@@H]7CCCN7C1=O)C(C)C
  • InChIKey: SEALOBQTUQIVGU-QNIJNHAOSA-N
    1S/C31H41N5O5/c1-16(2)26-28(38)35-11-7-10-24(35)31(40)36(26)29(39)30(41-31,17(3)4)33-27(37)19-12-21-20-8-6-9-22-25(20)18(14-32-22)13-23(21)34(5)15-19/h6,8-9,14,16-17,19,21,23-24,26,32,40H,7,10-13,15H2,1-5H3,(H,33,37)/t19-,21-,23-,24+,26+,30-,31+/m1/s1
  • Chirality: None
  • Inorganic: Missing data
  • Polymer: Missing data

Sources

IK4C1OC8NE   NCATS
dihydroergocornine *

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