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Details

Stereochemistry ABSOLUTE
Molecular Formula C36H55NO12
Molecular Weight 693.8214
Optical Activity UNSPECIFIED
Defined Stereocenters 18 / 18
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DESATRINE

SMILES

CC[C@@H](C)C(=O)O[C@H]1[C@H](O)[C@H]2[C@@H](CN3C[C@@H](C)CC[C@H]3[C@@]2(C)O)[C@@H]4C[C@@]56O[C@@]7(O)[C@@H]([C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]5[C@]14O)[C@]6(C)CC[C@@H]7O

InChI

InChIKey=HVONCUWNOXWZCA-LJOQNBCQSA-N
InChI=1S/C36H55NO12/c1-8-17(3)31(42)48-30-25(41)24-20(15-37-14-16(2)9-10-22(37)33(24,7)43)21-13-34-29(35(21,30)44)27(47-19(5)39)26(46-18(4)38)28-32(34,6)12-11-23(40)36(28,45)49-34/h16-17,20-30,40-41,43-45H,8-15H2,1-7H3/t16-,17+,20-,21-,22-,23-,24+,25+,26-,27+,28-,29+,30-,32-,33+,34+,35-,36-/m0/s1

HIDE SMILES / InChI

Molecular Formula C36H55NO12
Molecular Weight 693.8214
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 18 / 18
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 21:31:52 GMT 2025
Edited
by admin
on Mon Mar 31 21:31:52 GMT 2025
Record UNII
PLB0L4978Y
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DESATRINE [MI]
Preferred Name English
DESATRINE
MI  
Common Name English
PROTOVERINE 6,7-DIACETATE 15-((-)-(2R)-2-METHYLBUTYRATE)
Common Name English
PROTOVERINE, DIACETATE 15-(2-METHYLBUTYRATE
Systematic Name English
CEVANE-3,4,6,7,14,15,16,20-OCTOL, 4,9-EPOXY-, 6,7-DIACETATE 15-(2-METHYLBUTANOATE), (3.BETA.,4.ALPHA.,6.ALPHA.,7.ALPHA.,15.ALPHA.(R),16.BETA.)-
Systematic Name English
CEVANE-3,4,6,7,14,15,16,20-OCTOL, 4,9-EPOXY-, 6,7-DIACETATE 15-((2R)-2-METHYLBUTANOATE), (3.BETA.,4.ALPHA.,6.ALPHA.,7.ALPHA.,15.ALPHA.,16.BETA.)-
Systematic Name English
Code System Code Type Description
CAS
6746-01-6
Created by admin on Mon Mar 31 21:31:52 GMT 2025 , Edited by admin on Mon Mar 31 21:31:52 GMT 2025
PRIMARY
MERCK INDEX
m677
Created by admin on Mon Mar 31 21:31:52 GMT 2025 , Edited by admin on Mon Mar 31 21:31:52 GMT 2025
PRIMARY Merck Index
FDA UNII
PLB0L4978Y
Created by admin on Mon Mar 31 21:31:52 GMT 2025 , Edited by admin on Mon Mar 31 21:31:52 GMT 2025
PRIMARY
PUBCHEM
90479418
Created by admin on Mon Mar 31 21:31:52 GMT 2025 , Edited by admin on Mon Mar 31 21:31:52 GMT 2025
PRIMARY