MetaADEDB 2.0 @ LMMD
alisol B 23-acetate
(NLOAQXKIIGTTRE-JSWHPQHOSA-N)
Structure
SMILES
CC(=O)O[C@H]([C@H]1OC1(C)C)C[C@H](C1=C2C[C@H](O)[C@@H]3[C@]([C@]2(CC1)C)(C)CC[C@@H]1[C@]3(C)CCC(=O)C1(C)C)C
Molecular Formula:
C32H50O5
Molecular Weight:
514.736
Log P:
6.4109
Hydrogen Bond Acceptor:
5
Hydrogen Bond Donor:
1
TPSA:
76.13
CAS Number(s):
26575-95-1
Synonym(s)
1.
alisol B 23-acetate
2.
23-acetylalisol B
External Link(s)
MeSHC526957
PubChem Compound14036811
ZINC26828734
Adverse Drug Event(s)
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.