SF-1126

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 Search

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

Molecular Formula	C39H48N8O14
Molecular Weight	852.8436
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:11:35 UTC 2023` Edited by `admin` on `Sat Dec 16 11:11:35 UTC 2023`
Record UNII	DL0Q912033
Record Status	`Validated (UNII)`
Record Version

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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