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

Details

Stereochemistry ABSOLUTE
Molecular Formula C39H48N8O14
Molecular Weight 852.8436
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SF-1126

SMILES

NC(=N)NCCC[C@H](NC(=O)CCC(=O)OC[N+]1(CCOCC1)C2=CC(=O)C3=CC=CC(C4=CC=CC=C4)=C3O2)C(=O)NCC(=O)N[C@@H](CC([O-])=O)C(=O)N[C@@H](CO)C(O)=O

InChI

InChIKey=SVNJBEMPMKWDCO-KCHLEUMXSA-N
InChI=1S/C39H48N8O14/c40-39(41)42-13-5-10-26(36(55)43-20-31(51)45-27(18-33(52)53)37(56)46-28(21-48)38(57)58)44-30(50)11-12-34(54)60-22-47(14-16-59-17-15-47)32-19-29(49)25-9-4-8-24(35(25)61-32)23-6-2-1-3-7-23/h1-4,6-9,19,26-28,48H,5,10-18,20-22H2,(H9-,40,41,42,43,44,45,46,50,51,52,53,55,56,57,58)/t26-,27-,28-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
SF-1126
Code English
L-SERINE, N2-(1,4-DIOXO-4-((4-(4-OXO-8-PHENYL-4H-1-BENZOPYRAN-2-YL)MORPHOLINIUM-4-YL)METHOXY)BUTYL)-L-ARGINYLGLYCYL-L-.ALPHA.-ASPARTYL-, INNER SALT
Systematic Name English
PAN-PI3K/MTOR INHIBITOR SF1126
Common Name English
SF-1126 INNER SALT
Code English
SF 1126 [WHO-DD]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C129825
Created by admin on Sat Dec 16 11:11:35 GMT 2023 , Edited by admin on Sat Dec 16 11:11:35 GMT 2023
NCI_THESAURUS C2152
Created by admin on Sat Dec 16 11:11:35 GMT 2023 , Edited by admin on Sat Dec 16 11:11:35 GMT 2023
Code System Code Type Description
PUBCHEM
66577114
Created by admin on Sat Dec 16 11:11:35 GMT 2023 , Edited by admin on Sat Dec 16 11:11:35 GMT 2023
PRIMARY
CAS
936487-67-1
Created by admin on Sat Dec 16 11:11:35 GMT 2023 , Edited by admin on Sat Dec 16 11:11:35 GMT 2023
PRIMARY
NCI_THESAURUS
C85469
Created by admin on Sat Dec 16 11:11:35 GMT 2023 , Edited by admin on Sat Dec 16 11:11:35 GMT 2023
PRIMARY
ChEMBL
CHEMBL2326966
Created by admin on Sat Dec 16 11:11:35 GMT 2023 , Edited by admin on Sat Dec 16 11:11:35 GMT 2023
PRIMARY
FDA UNII
DL0Q912033
Created by admin on Sat Dec 16 11:11:35 GMT 2023 , Edited by admin on Sat Dec 16 11:11:35 GMT 2023
PRIMARY