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Details

Stereochemistry ABSOLUTE
Molecular Formula C34H53BrO8
Molecular Weight 669.684
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BROMOLASALOCID

SMILES

CC[C@H]([C@H]1O[C@@](CC)(C[C@@H]1C)[C@H]2CC[C@](O)(CC)[C@H](C)O2)C(=O)[C@@H](C)[C@@H](O)[C@H](C)CCC3=C(Br)C=C(C)C(O)=C3C(O)=O

InChI

InChIKey=RSSZDVNBQCABNN-DQBJLQAUSA-N
InChI=1S/C34H53BrO8/c1-9-23(31-20(6)17-34(11-3,43-31)26-14-15-33(41,10-2)22(8)42-26)30(38)21(7)28(36)18(4)12-13-24-25(35)16-19(5)29(37)27(24)32(39)40/h16,18,20-23,26,28,31,36-37,41H,9-15,17H2,1-8H3,(H,39,40)/t18-,20+,21+,22+,23+,26-,28+,31+,33-,34+/m1/s1

HIDE SMILES / InChI

Molecular Formula C34H53BrO8
Molecular Weight 669.684
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 10 / 10
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 17:57:36 GMT 2025
Edited
by admin
on Mon Mar 31 17:57:36 GMT 2025
Record UNII
TM60RNT0IA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BROMOLASALOCID
Common Name English
BR-X-537A
Preferred Name English
ANTIBIOTIC BR-X 537A
Common Name English
BENZOIC ACID, 3-BROMO-2-(7-(5-ETHYL-5-(5-ETHYLTETRAHYDRO-5-HYDROXY-6-METHYL-2H-PYRAN-2-YL)TETRAHYDRO-3-METHYL-2-FURANYL)-4-HYDROXY-3,5-DIMETHYL-6-OXONONYL)-6-HYDROXY-5-METHYL-, (2R-(2.ALPHA.(2S*(3R*,4S*,5S*,7R*),3S*,5S*),5.ALPHA.,6.BETA.))-
Systematic Name English
5-BROMOLASALOCID A
Common Name English
BENZOIC ACID, 3-BROMO-2-((3R,4S,5S,7R)-7-((2S,3S,5S)-5-ETHYL-5-((2R,5R,6S)-5-ETHYLTETRAHYDRO-5-HYDROXY-6-METHYL-2H-PYRAN-2-YL)TETRAHYDRO-3-METHYL-2-FURANYL)-4-HYDROXY-3,5-DIMETHYL-6-OXONONYL)-6-HYDROXY-5-METHYL-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID50959594
Created by admin on Mon Mar 31 17:57:36 GMT 2025 , Edited by admin on Mon Mar 31 17:57:36 GMT 2025
PRIMARY
FDA UNII
TM60RNT0IA
Created by admin on Mon Mar 31 17:57:36 GMT 2025 , Edited by admin on Mon Mar 31 17:57:36 GMT 2025
PRIMARY
PUBCHEM
5484221
Created by admin on Mon Mar 31 17:57:36 GMT 2025 , Edited by admin on Mon Mar 31 17:57:36 GMT 2025
PRIMARY
CAS
38784-08-6
Created by admin on Mon Mar 31 17:57:36 GMT 2025 , Edited by admin on Mon Mar 31 17:57:36 GMT 2025
PRIMARY
Related Record Type Details
ACTIVE MOIETY