MetaADEDB 2.0 @ LMMD
Novobiocin
(YJQPYGGHQPGBLI-KGSXXDOSSA-N)
Structure
SMILES
CO[C@@H]1[C@@H](OC(=O)N)[C@@H](O)[C@@H](OC1(C)C)Oc1ccc2c(c1C)oc(=O)c(c2O)NC(=O)c1ccc(c(c1)CC=C(C)C)O
Type(s)
Approved; Investigational; Vet_approved
Molecular Formula:
C31H36N2O11
Molecular Weight:
612.624
Log P:
4.4004
Hydrogen Bond Acceptor:
13
Hydrogen Bond Donor:
5
TPSA:
200.01
CAS Number(s):
303-81-1
Synonym(s)
1.
Novobiocin
2.
Crystallinic Acid
3.
Streptonivicin
4.
Novobiocin Calcium
5.
Novobiocin Sodium
6.
Novobiocin, Monosodium Salt
7.
Calcium, Novobiocin
8.
Monosodium Salt Novobiocin
9.
Sodium, Novobiocin
External Link(s)
MeSHD009675
PubChem Compound54675769
BindingDB282
50226181
ChEBI28368
CHEMBLCHEMBL36506
DrugBankDB01051
DrugCentral1974
KEGGcpd:C05080
Therapeutic Target DatabaseD0Q0PR
ZINC14879999
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1HypersensitivityCanada Vigilance: 1Canada Vigilance
2UrticariaCanada Vigilance: 2Canada Vigilance
3WheezingCanada Vigilance: 1Canada Vigilance
4melanoma1739614CTD
Powered by :

Page last updated at 2020-05-25 10:01:57 (Asia/Shanghai) | You are visitor No. 120265

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.