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(2S,5R,6R)-6-[(E)-[(azepan-1-yl)methylidene]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Compound number:
MolPort-006-069-414
CAS number: 32887-01-7
IUPAC:
(2S,5R,6R)-6-[(E)-[(azepan-1-yl)methylidene]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
IUPAC traditional:
amdinocillin
SMILES:
CC1(C)S[C@@H]2[C@H](\N=C\N3CCCCCC3)C(=O)N2[C@H]1C(O)=O
InChI key:
BWWVAEOLVKTZFQ-ISVUSNJMSA-N
Molecular formula: C15H23N3O3S
Molecular weight: 325.43

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Supplier Catalogue Data


Catalog: Building blocks Ships out: 5 business days Purity: 95%
Last updated: > 3 months ago In warehouse: Unverified
Pack size Ships out Price Qty
1 g November 28, 2018 58.40 USD
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5 g November 28, 2018 150.38 USD
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10 g November 28, 2018 286.16 USD
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More Information

Compound Identifiers
Compound number: MolPort-006-069-414
CAS number: 32887-01-7

Names, Synonyms and 3rd Party Identifiers
Name: MFCD00056869
(2S,5R,6R)-6-[(E)-(azepan-1-ylmethylidene)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
MECILLINAM

InChI
InChI: 1S/C15H23N3O3S/c1-15(2)11(14(20)21)18-12(19)10(13(18)22-15)16-9-17-7-5-3-4-6-8-17/h9-11,13H,3-8H2,1-2H3,(H,20,21)/b16-9+/t10-,11+,13-/m1/s1
InChI key: BWWVAEOLVKTZFQ-ISVUSNJMSA-N

Calculated Properties
Molecular formula: C15H23N3O3S
Molecular weight: 325.43

Other

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2018 MolPort, v2.61, release date 09-11-2018 09:00 (+0200). All rights reserved.
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