U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C33H50O8
Molecular Weight 574.7453
Optical Activity UNSPECIFIED
Defined Stereocenters 11 / 11
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of CEPHALOSPORIN P1

SMILES

C[C@@H]1[C@H](O)CC[C@@]2(C)[C@H]1[C@@H](OC(C)=O)[C@H](O)[C@@]3(C)[C@H]2CC[C@H]4\C([C@H](C[C@]34C)OC(C)=O)=C(/CCC=C(C)C)C(O)=O

InChI

InChIKey=YJJWILCYIMMPAS-VALXSNPUSA-N
InChI=1S/C33H50O8/c1-17(2)10-9-11-21(30(38)39)26-22-12-13-25-31(6)15-14-23(36)18(3)27(31)28(41-20(5)35)29(37)33(25,8)32(22,7)16-24(26)40-19(4)34/h10,18,22-25,27-29,36-37H,9,11-16H2,1-8H3,(H,38,39)/b26-21-/t18-,22+,23-,24+,25+,27-,28-,29+,31-,32+,33-/m1/s1

HIDE SMILES / InChI

Molecular Formula C33H50O8
Molecular Weight 574.7453
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 11 / 11
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 19:57:14 GMT 2025
Edited
by admin
on Mon Mar 31 19:57:14 GMT 2025
Record UNII
2U8E6JLQ1J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACREMONIC ACID
Preferred Name English
CEPHALOSPORIN P1
MI  
Common Name English
(3.ALPHA.,4.ALPHA.,6.ALPHA.,7.BETA.,8.ALPHA.,9.BETA.,13.ALPHA.,14.BETA.,16.BETA.,17Z)-6,16-BIS(ACETYLOXY)-3,7-DIHYDROXY-29-NORDAMMARA-17(20),24-DIEN-21-OIC ACID
Systematic Name English
CEPHALOSPORIN P1 [MI]
Common Name English
29-NORDAMMARA-17(20),24-DIEN-21-OIC ACID, 6,16-BIS(ACETYLOXY)-3,7-DIHYDROXY-, (3.ALPHA.,4.ALPHA.,6.ALPHA.,7.BETA.,8.ALPHA.,9.BETA.,13.ALPHA.,14.BETA.,16.BETA.,17Z)-
Systematic Name English
CEPHALOSPORIN P
Common Name English
Code System Code Type Description
MERCK INDEX
m3249
Created by admin on Mon Mar 31 19:57:14 GMT 2025 , Edited by admin on Mon Mar 31 19:57:14 GMT 2025
PRIMARY Merck Index
EPA CompTox
DTXSID601316644
Created by admin on Mon Mar 31 19:57:14 GMT 2025 , Edited by admin on Mon Mar 31 19:57:14 GMT 2025
PRIMARY
CAS
13258-72-5
Created by admin on Mon Mar 31 19:57:14 GMT 2025 , Edited by admin on Mon Mar 31 19:57:14 GMT 2025
PRIMARY
FDA UNII
2U8E6JLQ1J
Created by admin on Mon Mar 31 19:57:14 GMT 2025 , Edited by admin on Mon Mar 31 19:57:14 GMT 2025
PRIMARY
PUBCHEM
3037114
Created by admin on Mon Mar 31 19:57:14 GMT 2025 , Edited by admin on Mon Mar 31 19:57:14 GMT 2025
PRIMARY
CAS
28393-42-2
Created by admin on Mon Mar 31 19:57:14 GMT 2025 , Edited by admin on Mon Mar 31 19:57:14 GMT 2025
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