3-[[(3S,5S)-5-[[[5-[(Dimethylamino)carbonyl]-3-pyridinyl]amino]carbonyl]-3-pyrrolidinyl]thio]-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid, (4R,5S,6S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H29N5O6S
Molecular Weight	503.571
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-[[(3S,5S)-5-[[[5-[(Dimethylamino)carbonyl]-3-pyridinyl]amino]carbonyl]-3-pyrrolidinyl]thio]-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid, (4R,5S,6S)-

Structure Search

SMILES

[H][C@]12[C@@H](C)C(S[C@@H]3CN[C@@H](C3)C(=O)NC4=CN=CC(=C4)C(=O)N(C)C)=C(N1C(=O)[C@]2([H])[C@@H](C)O)C(O)=O

InChI

InChIKey=FUPQEGQNIKUCOF-IPMVXICZSA-N

InChI=1S/C23H29N5O6S/c1-10-17-16(11(2)29)22(32)28(17)18(23(33)34)19(10)35-14-6-15(25-9-14)20(30)26-13-5-12(7-24-8-13)21(31)27(3)4/h5,7-8,10-11,14-17,25,29H,6,9H2,1-4H3,(H,26,30)(H,33,34)/t10-,11-,14+,15+,16-,17-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C23H29N5O6S
Molecular Weight	503.571
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 20:17:28 GMT 2023` Edited by `admin` on `Sat Dec 16 20:17:28 GMT 2023`
Record UNII	Q7AT5E54NF
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-[[(3S,5S)-5-[[[5-[(Dimethylamino)carbonyl]-3-pyridinyl]amino]carbonyl]-3-pyrrolidinyl]thio]-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid, (4R,5S,6S)-

Systematic Name

English

(4R,5S,6S)-3-[[(3S,5S)-5-[[[5-[(Dimethylamino)carbonyl]-3-pyridinyl]amino]carbonyl]-3-pyrrolidinyl]thio]-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systematic Name

English

1-Azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid, 3-[[(3S,5S)-5-[[[5-[(dimethylamino)carbonyl]-3-pyridinyl]amino]carbonyl]-3-pyrrolidinyl]thio]-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-, (4R,5S,6S)-

Systematic Name

English

Code System Code Type Description

FDA UNII

Q7AT5E54NF

Created by admin on Sat Dec 16 20:17:28 GMT 2023 , Edited by admin on Sat Dec 16 20:17:28 GMT 2023

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CAS

1131483-70-9

Created by admin on Sat Dec 16 20:17:28 GMT 2023 , Edited by admin on Sat Dec 16 20:17:28 GMT 2023

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PUBCHEM

25222143

Created by admin on Sat Dec 16 20:17:28 GMT 2023 , Edited by admin on Sat Dec 16 20:17:28 GMT 2023

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