MetaADEDB 2.0 @ LMMD
Dihydroergocornine
(SEALOBQTUQIVGU-QNIJNHAOSA-N)
Structure
SMILES
O=C([C@H]1CN(C)[C@H]2[C@H](C1)c1cccc3c1c(C2)c[nH]3)N[C@@]1(O[C@@]2(N(C1=O)[C@@H](C(C)C)C(=O)N1[C@H]2CCC1)O)C(C)C
Type(s)
Approved
Molecular Formula:
C31H41N5O5
Molecular Weight:
563.688
Log P:
2.3351
Hydrogen Bond Acceptor:
9
Hydrogen Bond Donor:
3
TPSA:
118.21
CAS Number(s):
25447-65-8
Synonym(s)
1.
Dihydroergocornine
2.
Dihydroergocornine Mesylate
3.
Dihydroergocornine Monomesylate
4.
Ergocornine, 9,10-dihydro-
5.
Mesylate, Dihydroergocornine
6.
Monomesylate, Dihydroergocornine
External Link(s)
MeSHD025441
PubChem Compound168871
ChEBI59909
CHEMBLCHEMBL2365712
DrugBankDB11273
DrugCentral3184
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Vertigo2635498CTD
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