CEFDITOREN OPEN RING DIMER

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C50H56N12O14S6
Molecular Weight	1241.442
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	4
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CO\N=C(/C(=O)N[C@@H]([C@@H]1NC(C(=O)OCOC(=O)C(C)(C)C)=C(CS1)\C=C/C2=C(C)N=CS2)C(=O)NC3=NC(=CS3)C(=N\OC)\C(=O)N[C@H]4[C@H]5SCC(\C=C/C6=C(C)N=CS6)=C(N5C4=O)C(=O)OCOC(=O)C(C)(C)C)C7=CSC(N)=N7

InChI

InChIKey=JWZGOAMNOUQLNB-AFLUGGDSSA-N

InChI=1S/C50H56N12O14S6/c1-23-29(81-19-52-23)13-11-25-15-77-40(58-31(25)43(67)73-21-75-45(69)49(3,4)5)34(56-37(63)32(60-71-9)27-17-79-47(51)54-27)39(65)59-48-55-28(18-80-48)33(61-72-10)38(64)57-35-41(66)62-36(44(68)74-22-76-46(70)50(6,7)8)26(16-78-42(35)62)12-14-30-24(2)53-20-82-30/h11-14,17-20,34-35,40,42,58H,15-16,21-22H2,1-10H3,(H2,51,54)(H,56,63)(H,57,64)(H,55,59,65)/b13-11-,14-12-,60-32-,61-33-/t34-,35-,40-,42-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C50H56N12O14S6
Molecular Weight	1241.442
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	4
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:41:05 GMT 2025` Edited by `admin` on `Mon Mar 31 23:41:05 GMT 2025`
Record UNII	WV7F2MN9UR
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CEFDITOREN OPEN RING DIMER

Common Name

English

5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID, 7-(((2Z)-2-(2-(((2R)-2-(((2Z)-2-(2-AMINO-4-THIAZOLYL)-2-(METHOXYIMINO)ACETYL)AMINO)-2-((2R)-4-(((2,2-DIMETHYL-1-OXOPROPOXY)METHOXY)CARBONYL)-3,6-DIHYDRO-5-((1Z)-2-(4-METHYL-5-THIAZOLYL)ETHENYL)-2H-1,

Preferred Name

English

Code System Code Type Description

CAS

2410655-60-4

Created by admin on Mon Mar 31 23:41:05 GMT 2025 , Edited by admin on Mon Mar 31 23:41:05 GMT 2025

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PUBCHEM

156028039

Created by admin on Mon Mar 31 23:41:05 GMT 2025 , Edited by admin on Mon Mar 31 23:41:05 GMT 2025

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FDA UNII

WV7F2MN9UR

Created by admin on Mon Mar 31 23:41:05 GMT 2025 , Edited by admin on Mon Mar 31 23:41:05 GMT 2025

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