(Q27122556)

PICIBANIL (English)

6 October 2016

C₁₆H₁₇N₂O₄S⁻

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CC1(C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3)C(=O)[O-])C

1 reference

PICIBANIL (English)

6 October 2016

CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)CC3=CC=CC=C3)C(=O)[O-])C

1 reference

PICIBANIL (English)

InChI=1S/C16H18N2O4S/c1-16(2)12(15(21)22)18-13(20)11(14(18)23-16)17-10(19)8-9-6-4-3-5-7-9/h3-7,11-12,14H,8H2,1-2H3,(H,17,19)(H,21,22)/p-1/t11-,12+,14-/m1/s1

6 October 2016

Identifiers

InChI

1 reference

JGSARLDLIJGVTE-MBNYWOFBSA-M

PICIBANIL (English)

6 October 2016

2 references

PICIBANIL (English)

6 October 2016

ChEBI release 2020-09-01

2 references

benzylpenicillin(1-) (English)

JGSARLDLIJGVTE-MBNYWOFBSA-M

6 October 2016

InChIKey

8 April 2021

https://commonchemistry.cas.org/detail?cas_rn=54836-26-9

1 reference

(2S,5R,6R)-3,3-Dimethyl-7-oxo-6-[(phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate (English)

6 October 2016

1 reference

PICIBANIL (English)

6 October 2016

Reaxys registry number

3915298

1 reference

benzylpenicillin(1-) (English)

6 October 2016

ChEBI ID

51354

mapping relation type

1 reference