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

Details

Stereochemistry ABSOLUTE
Molecular Formula C41H79N3O12
Molecular Weight 806.0789
Optical Activity UNSPECIFIED
Defined Stereocenters 18 / 18
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TULATHROMYCIN B

SMILES

[H][C@@]1(C[C@@](C)(OC)[C@](O)(CNCCC)[C@H](C)O1)O[C@H]2[C@H](C)[C@@H](O[C@]3([H])O[C@H](C)C[C@@H]([C@H]3O)N(C)C)[C@](C)(O)C[C@@H](C)CN[C@H](C)[C@@]([H])(OC(=O)[C@@H]2C)[C@](C)(O)[C@H](O)CC

InChI

InChIKey=JEBMHQVCOAWRCT-QPTWMBCESA-N
InChI=1S/C41H79N3O12/c1-15-17-42-22-41(50)28(8)53-31(20-39(41,10)51-14)54-33-25(5)34(56-37-32(46)29(44(12)13)18-24(4)52-37)38(9,48)19-23(3)21-43-27(7)35(55-36(47)26(33)6)40(11,49)30(45)16-2/h23-35,37,42-43,45-46,48-50H,15-22H2,1-14H3/t23-,24-,25+,26-,27-,28+,29+,30-,31+,32-,33+,34-,35-,37+,38-,39-,40-,41+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
TULATHROMYCIN B
MI  
Common Name English
CP-547272
Code English
TULATHROMYCIN B [MI]
Common Name English
TULATHROMYCIN COMPONENT B
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C261
Created by admin on Fri Dec 15 16:04:57 GMT 2023 , Edited by admin on Fri Dec 15 16:04:57 GMT 2023
Code System Code Type Description
EPA CompTox
DTXSID10950800
Created by admin on Fri Dec 15 16:04:57 GMT 2023 , Edited by admin on Fri Dec 15 16:04:57 GMT 2023
PRIMARY
NCI_THESAURUS
C80958
Created by admin on Fri Dec 15 16:04:57 GMT 2023 , Edited by admin on Fri Dec 15 16:04:57 GMT 2023
PRIMARY
MERCK INDEX
m11260
Created by admin on Fri Dec 15 16:04:57 GMT 2023 , Edited by admin on Fri Dec 15 16:04:57 GMT 2023
PRIMARY Merck Index
PUBCHEM
71244897
Created by admin on Fri Dec 15 16:04:57 GMT 2023 , Edited by admin on Fri Dec 15 16:04:57 GMT 2023
PRIMARY
CAS
280755-12-6
Created by admin on Fri Dec 15 16:04:57 GMT 2023 , Edited by admin on Fri Dec 15 16:04:57 GMT 2023
PRIMARY
FDA UNII
T5PDD839DA
Created by admin on Fri Dec 15 16:04:57 GMT 2023 , Edited by admin on Fri Dec 15 16:04:57 GMT 2023
PRIMARY
SMS_ID
300000023862
Created by admin on Fri Dec 15 16:04:57 GMT 2023 , Edited by admin on Fri Dec 15 16:04:57 GMT 2023
PRIMARY