MetaADEDB 2.0 @ LMMD
dinophysistoxin 1
(CLBIEZBAENPDFY-ZHACJKMWSA-N)
Structure
SMILES
CC1=CC2(OC(C1)C(/C=C/C1CCC3(O1)CCC1C(O3)C(O)C(=C)C(O1)C(CC(C1OC3(OCCCC3C)CCC1C)C)O)C)OC(CCC2O)CC(C(=O)O)(O)C
Molecular Formula:
C45H70O13
Molecular Weight:
819.030
Log P:
5.4596
Hydrogen Bond Acceptor:
13
Hydrogen Bond Donor:
5
TPSA:
182.83
CAS Number(s):
81720-10-7
Synonym(s)
1.
dinophysistoxin 1
2.
35S-methylokadaic acid
3.
DTX-1 protein, Dinophysis
4.
DTX1
5.
dinophysistoxin-1
6.
dinophytoxin-1
External Link(s)
MeSHC051904
PubChem Compound6437058
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Shellfish Poisoning19916524
21512803
CTD
Powered by :

Page last updated at 2020-05-25 10:01:57 (Asia/Shanghai) | You are visitor No. 120262

Copyright © 2019-2020 Laboratory of Molecular Modeling and Design, Shanghai Key Laboratory of New Drug Design, School of Pharmacy, East China University of Science and Technology. All rights reserved.