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Details

Stereochemistry MIXED
Molecular Formula C35H46O11
Molecular Weight 642.7331
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 8
E/Z Centers 3
Charge 0

SHOW SMILES / InChI
Structure of TRICHOVERRITONE

SMILES

CC(O)C(OCCC1=CC(=O)OC1)\C=C\C=C/C(=O)O[C@@H]2C[C@H]3O[C@@H]4C=C(C)CC[C@]4(COC(=O)\C=C(/C)CCO)[C@]2(C)[C@]35CO5

InChI

InChIKey=SBZMQFWYHDOLHG-MZKSFLEOSA-N
InChI=1S/C35H46O11/c1-22-9-12-34(20-43-31(39)16-23(2)10-13-36)28(15-22)45-29-18-27(33(34,4)35(29)21-44-35)46-30(38)8-6-5-7-26(24(3)37)41-14-11-25-17-32(40)42-19-25/h5-8,15-17,24,26-29,36-37H,9-14,18-21H2,1-4H3/b7-5+,8-6-,23-16+/t24?,26?,27-,28-,29-,33-,34-,35+/m1/s1

HIDE SMILES / InChI

Molecular Formula C35H46O11
Molecular Weight 642.7331
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 6 / 8
E/Z Centers 3
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:23:50 GMT 2025
Edited
by admin
on Mon Mar 31 23:23:50 GMT 2025
Record UNII
94H6HXM1FG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TRICHOTHEC-9-ENE-4,15-DIOL, 12,13-EPOXY-, 4-((2Z,4E)-6-(2-(2,5-DIHYDRO-5-OXO-3-FURANYL)ETHOXY)-7-HYDROXY-2,4-OCTADIENOATE) 15-((2E)-5-HYDROXY-3-METHYL-2-PENTENOATE), (4.BETA.)-
Preferred Name English
TRICHOVERRITONE
Common Name English
TRICHOTHEC-9-ENE-4,15-DIOL, 12,13-EPOXY-, 4-(6-(2-(2,5-DIHYDRO-5-OXO-3-FURANYL)ETHOXY)-7-HYDROXY-2,4-OCTADIENOATE) 15-(5-HYDROXY-3-METHYL-2-PENTENOATE), (4.BETA.(2Z,4E),15(E))-
Systematic Name English
Code System Code Type Description
FDA UNII
94H6HXM1FG
Created by admin on Mon Mar 31 23:23:50 GMT 2025 , Edited by admin on Mon Mar 31 23:23:50 GMT 2025
PRIMARY
PUBCHEM
102595325
Created by admin on Mon Mar 31 23:23:50 GMT 2025 , Edited by admin on Mon Mar 31 23:23:50 GMT 2025
PRIMARY
CAS
87292-19-1
Created by admin on Mon Mar 31 23:23:50 GMT 2025 , Edited by admin on Mon Mar 31 23:23:50 GMT 2025
PRIMARY