S-ACETYL-(S)-4'-PHOSPHOPANTETHEINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C13H25N2O8PS
Molecular Weight	400.385
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of S-ACETYL-(S)-4'-PHOSPHOPANTETHEINE

Structure Search

SMILES

CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(O)(O)=O

InChI

InChIKey=AJFWMDFTVVFMHY-NSHDSACASA-N

InChI=1S/C13H25N2O8PS/c1-9(16)25-7-6-14-10(17)4-5-15-12(19)11(18)13(2,3)8-23-24(20,21)22/h11,18H,4-8H2,1-3H3,(H,14,17)(H,15,19)(H2,20,21,22)/t11-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C13H25N2O8PS
Molecular Weight	400.385
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 20:55:43 GMT 2025` Edited by `admin` on `Tue Apr 01 20:55:43 GMT 2025`
Record UNII	8B9694ED46
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ETHANETHIOIC ACID, S-(2-((3-((2-HYDROXY-3,3-DIMETHYL-1-OXO-4-(PHOSPHONOOXY)BUTYL)AMINO)-1-OXOPROPYL)AMINO)ETHYL) ESTER, (R)-

Preferred Name

English

S-ACETYL-(S)-4'-PHOSPHOPANTETHEINE

Common Name

English

Code System Code Type Description

FDA UNII

8B9694ED46