MetaADEDB 2.0 @ LMMD
Indican
(XVARCVCWNFACQC-RKQHYHRCSA-N)
Structure
SMILES
OC[C@H]1O[C@@H](Oc2c[nH]c3c2cccc3)[C@@H]([C@H]([C@@H]1O)O)O
Molecular Formula:
C14H17NO6
Molecular Weight:
295.288
Log P:
-0.6534
Hydrogen Bond Acceptor:
6
Hydrogen Bond Donor:
5
TPSA:
115.17
CAS Number(s):
487-60-5
Synonym(s)
1.
Indican
2.
1H-Indol-3-ol Hydrogen Sulfate Ester
3.
Indican Monopotassium Salt
4.
Indican Monosodium Salt
5.
Indoxyl Sulfate
6.
Monopotassium Salt, Indican
7.
Monosodium Salt, Indican
8.
Sulfate, Indoxyl
External Link(s)
MeSHD007200
PubChem Compound441564
ChEBI16700
CHEMBLCHEMBL2063300
ZINC4097614
Adverse Drug Event(s)
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