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| CAS Number | 61477-96-1 |
| Catalog Number | AG00IAVJ(AGN-PC-0T0LDB) |
| Chemical Name | Piperacillin |
| IUPAC Name | (2S,5R,6R)-6-[[(2R)-2-[(4-ethyl-2,3-dioxopiperazine-1-carbonyl)amino]-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid |
| InChI | InChI=1S/C23H27N5O7S/c1-4-26-10-11-27(19(32)18(26)31)22(35)25-13(12-8-6-5-7-9-12)16(29)24-14-17(30)28-15(21(33)34)23(2,3)36-20(14)28/h5-9,13-15,20H,4,10-11H2,1-3H3,(H,24,29)(H,25,35)(H,33,34)/t13-,14-,15+,20-/m1/s1 |
| InChI Key | IVBHGBMCVLDMKU-GXNBUGAJSA-N |
| MDL Number | MFCD26142884 |
| Molecular Formula | C23H27N5O7S |
| Molecular Weight | 517.5548 |
| SMILES | C(C)N1C(C(N(CC1)C(=O)N[C@@H](C(=O)N[C@H]1[C@H]2SC([C@@H](N2C1=O)C(=O)O)(C)C)C1=CC=CC=C1)=O)=O |
| UNII | 9I628532GX |
| Synonyms | AB Piperacillin,
AB-Piperacillin,
Cl 227193,
Cl-227193,
Cl227193,
Curasan, Piperacillin,
Monosodium Salt, Piperacillin,
Pipcil,
Pipera hameln,
Pipera-hameln,
Piperacillin,
Piperacillin curasan,
Piperacillin Fresenius,
Piperacillin Hexal,
Piperacillin Monosodium Salt,
Piperacillin ratiopharm,
Piperacillin Sodium,
Piperacillin-ratiopharm,
Pipercillin,
Pipracil,
Pipril,
Salt, Piperacillin Monosodium,
Sodium, Piperacillin,
T 1220,
T-1220,
T1220,
piperacillin,
Pipracil,
61477-96-1,
Piperacillin anhydrous,
Piperacilline,
Piperacilina,
Piperacillinum,
PIPERACILLIN SODIUM,
Pipril,
Piperacillin (INN),
Piperacillin [INN],
CCRIS 7362,
CHEBI:8232,
UNII-9I628532GX,
C23H27N5O7S,
EINECS 262-811-8,
(2S,5R,6R)-6-{[(2R)-2-{[(4-ethyl-2,3-dioxopiperazin-1-yl)carbonyl]amino}-2-phenylacetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,
CHEMBL702,
PIPC,
Cl-227193,
IVBHGBMCVLDMKU-GXNBUGAJSA-N,
Pentcillin,
9I628532GX,
66258-76-2,
Pipercillin,
6-(D-(-)-alpha-(4-Ethyl-2,3-dioxo-1-piperazinecarboxamido)phenylacetamido)penicillanic acid,
(2S,5R,6R)-6-[[(2R)-2-[(4-ethyl-2,3-dioxopiperazine-1-carbonyl)amino]-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,
(2S-(2alpha,5alpha,6beta(S*)))-6-(((((4-Ethyl-2,3-dioxopiperazin-1-yl)carbonyl)amino)phenylacetyl)amino)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid,
4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-(((((4-ethyl-2,3-dioxo-1-piperazinyl)carbonyl)amino)phenylacetyl)amino)-3,3-dimethyl-7-oxo-, (2S-(2alpha,5alpha,6beta(S*)))-,
6beta-{(2R)-2-[(4-ethyl-2,3-dioxopiperazin-1-yl)carboxamido]-2-phenylacetamido}-2,2-dimethylpenam-3alpha-carboxylic acid,
CL 227193,
Peperacillin,
T 1220,
Pipracil, Piper,
Piperacillin Monosodium Salt,
(2S,5R,6R)-6-[[(2R)-2-[(4-ethyl-2,3-dioxo-piperazine-1-carbonyl)amino]-2-phenyl-acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,
4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 3,3-dimethyl-6-(((((4-ethyl-2,3-dioxo-1-piperazinyl)carbonyl)amino)phenylacetyl)amino)-7-oxo-, (2S-(2-alpha,5-alpha,6-beta(S*)))-,
Peracin (TN),
Piperacillin (anhydrous),
Isipen,
1-carboxamido)-2-phenylacetamido)-3,3-dimethyl-,
Pipracil,(S),
PIPERACILLIN NA,
AC1L2ACR,
AC1Q5QXJ,
Prestwick0_000755,
Prestwick1_000755,
Prestwick2_000755,
Prestwick3_000755,
Epitope ID:116652,
4-ethyl-2,3-dioxopiperazine carbonyl ampicillin,
SCHEMBL33894,
BSPBio_000770,
BIDD:GT0167,
SPBio_002709,
BPBio1_000848,
DTXSID2023482,
HMS2090H19,
ZINC3913937,
BDBM50240426,
KM0517,
MFCD00865043,
AKOS016007827,
API0025892,
DB00319,
AJ-47426,
AK105051,
AN-39299,
AS-13671,
SC-27336,
AX8239259,
LS-149794,
FT-0630727,
C14034,
D08380,
J10085,
AB01275515-01,
127490-EP2272832A1,
127490-EP2292612A2,
127490-EP2295402A2,
477P961,
Piperacillin, Antibiotic for Culture Media Use Only,
W-105153,
BRD-K86873305-236-03-0,
(2S,5R,6R)-6-((R)-2-(4-ethyl-2,3-dioxopiperazine-,
(2S,5R,6R)-6-((R)-2-(4-ethyl-2,3-dioxopiperazine-1-carboxamido)-2-phenylacetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,
(2S,5R,6R)-6-[(2R)-2-{[(4-ethyl-2,3-dioxopiperazin-1-yl)carbonyl]amino}-2-phenylacetamido]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,
(2S,5R,6R)-6-[[(2R)-[[(4-ETHYL-2,3-DIOXO-1-PIPERAZINYL)CARBONYL]AMINO]PHENYLACETYL]AMINO]-3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO[3.2.0]HEPTANE-2-CARBOXYLIC ACID,
(2S,5R,6R)-6-[[(2R)-2-[[(4-Ethyl-2,3-dioxo-1-piperazinyl)carbonyl]amino]-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic Acid,
4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[[(2R)-[[(4-ethyl-2,3-dioxo-1-piperazinyl)carbonyl]amino]phenylacetyl]amino]-3,3-dimethyl-7-oxo-, (2S,5R,6R)-,
4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[[(2R)-2-[[(4-ethyl-2,3-dioxo-1-piperazinyl)carbonyl]amino]-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-, (2S,5R,6R)-,
WPP,
Piperacillina,
Peracin,
Pipcil,
Pipera hameln,
Pipera-hameln,
AB Piperacillin,
AB-Piperacillin,
Piperacillin Hexal,
Zobactin (TN),
Piperacillin curasan,
Piperacillin hydrate,
Tazocin (TN),
Sodium, Piperacillin,
Curasan, Piperacillin,
Zosyn (TN),
Piperacillin Fresenius,
Piperacillin [USAN],
Piperacillin ratiopharm,
Piperacillin-ratiopharm,
TAZOBACTAM SODIUM,
Piperacilina [INN-Spanish],
Piperacilline [INN-French],
Piperacillinum [INN-Latin],
D04ZAH,
UNII-X00B0D5O0E,
Monosodium Salt, Piperacillin,
Salt, Piperacillin Monosodium,
Piperacillin [USP:INN:BAN],
PIPERACILLIN SODIUM SALT,
C23H27N5O7S.H2O,
CID43672,
C23-H27-N5-O7-S,
Cl227193,
CS-O-14488,
T-1220,
T1220,
C23-H27-N5-O7-S.H2-O,
D010878,
7-Oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,
59703-84-3,
6-(D-(-)-alpha-(4-Ethyl-2,3-dioxo-1-piperazinecarboxamido)phenylacetamido)penicillanicacid,
(2S,5R,6R)-6-((R)-2-(4-Ethyl-2,3-dioxo-1-piperazinecarboxamido)-2-phenylacetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid monohydrate,
[2S-[2alpha,5alpha,6beta(S*)]]-6-[[[[(4-ethyl-2,3-dioxopiperazin-1-yl)carbonyl]amino]phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,
4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[[[[(4-ethyl-2,3-dioxo-1-piperazinyl)carbonyl]amino]phenylacetyl]amino]-3,3-dimethyl-7-oxo-, monohydrate, [2S-[2.alpha.,5.alpha.,6.beta.(S*)]]-,
|
| Complexity | 982 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 4 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 517.163g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 36 |
| Hydrogen Bond Acceptor Count | 8 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 517.557g/mol |
| Monoisotopic Mass | 517.163g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 182A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
| Symbol: | |
| Hazard Class | |
| Hazard statements | H317-H334 |
| Packing Group | |
| Precautionary statements | P261-P280g-P284-P304+P340-P342+P311a-P501a |
| UN Code |
| Chemical Name: | Batch Number: | |
| Chemical Structure: | CAS Registry No: | |
| Product ID: | ||
| Manufacture Date: | ||
| Storage Temperature: | ||
| Formula: | ||
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| Test: | Result: |

