U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C20H31N2O9P
Molecular Weight 474.4419
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FOSMETPANTOTENATE, (4R)-

SMILES

COC(=O)CCNC(=O)[C@H](O)C(C)(C)CO[P@](=O)(N[C@@H](C)C(=O)OC)OC1=CC=CC=C1

InChI

InChIKey=HUWUHKIPYXWUPN-MUIAOOQVSA-N
InChI=1S/C20H31N2O9P/c1-14(19(26)29-5)22-32(27,31-15-9-7-6-8-10-15)30-13-20(2,3)17(24)18(25)21-12-11-16(23)28-4/h6-10,14,17,24H,11-13H2,1-5H3,(H,21,25)(H,22,27)/t14-,17-,32+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
FOSMETPANTOTENATE, (4R)-
Common Name English
5-OXA-3,10-DIAZA-4-PHOSPHATRIDECANEDIOIC ACID, 8-HYDROXY-2,7,7-TRIMETHYL-9-OXO-4-PHENOXY-, 1,13-DIMETHYL ESTER, 4-OXIDE, (2S,4R,8R)-
Systematic Name English
Code System Code Type Description
PUBCHEM
122173981
Created by admin on Sat Dec 16 12:52:09 UTC 2023 , Edited by admin on Sat Dec 16 12:52:09 UTC 2023
PRIMARY
CAS
1477482-16-8
Created by admin on Sat Dec 16 12:52:09 UTC 2023 , Edited by admin on Sat Dec 16 12:52:09 UTC 2023
PRIMARY
EU-Orphan Drug
EU/3/16/1612 (POSITIVE)
Created by admin on Sat Dec 16 12:52:09 UTC 2023 , Edited by admin on Sat Dec 16 12:52:09 UTC 2023
PRIMARY
FDA UNII
FD7K3338YY
Created by admin on Sat Dec 16 12:52:09 UTC 2023 , Edited by admin on Sat Dec 16 12:52:09 UTC 2023
PRIMARY
SMS_ID
300000018875
Created by admin on Sat Dec 16 12:52:09 UTC 2023 , Edited by admin on Sat Dec 16 12:52:09 UTC 2023
PRIMARY