(8S,11S)-10-oxo-11-(sulfanylmethyl)-9-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene-8-carboxylic acid

Modify Date: 2025-11-25 15:57:24

(8S,11S)-10-oxo-11-(sulfanylmethyl)-9-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene-8-carboxylic acid Structure
(8S,11S)-10-oxo-11-(sulfanylmethyl)-9-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene-8-carboxylic acid structure
Common Name (8S,11S)-10-oxo-11-(sulfanylmethyl)-9-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene-8-carboxylic acid
CAS Number 186376-96-5 Molecular Weight 335.46100
Density N/A Boiling Point N/A
Molecular Formula C18H25NO3S Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name (8S,11S)-10-oxo-11-(sulfanylmethyl)-9-azabicyclo[11.3.1]heptadeca-1(17),13,15-triene-8-carboxylic acid
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C18H25NO3S
Molecular Weight 335.46100
Exact Mass 335.15600
PSA 108.69000
LogP 3.12700
InChIKey KLCDUNQMSZJEDY-CVEARBPZSA-N
SMILES O=C1NC(C(=O)O)CCCCCCc2cccc(c2)CC1CS

 Synonyms

UNII-D474W0A165
5-Azabicyclo(11.3.1)heptadeca-1(17),13,15-triene-6-carboxylic acid,3-(mercaptomethyl)-4-oxo-,(3S,6S)
5-Azabicyclo(11.3.1)heptadeca-1(17),13,15-triene-6-carboxylic acid,3-(mercaptomethyl)-4-oxo-,(3S-(3R*,6R*))
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