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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H34O8
Molecular Weight 426.5006
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Cinnzeylanin

SMILES

CC(C)[C@@]1(O)C[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5([C@H](OC(C)=O)[C@@H](C)CC[C@]35O)[C@@]2(O)[C@]14C

InChI

InChIKey=DFYFOAFKHRTQLA-PIKMFBPASA-N
InChI=1S/C22H34O8/c1-11(2)17(24)10-19(26)15(5)9-20(27)16(17,6)22(19,28)21(30-20)14(29-13(4)23)12(3)7-8-18(15,21)25/h11-12,14,24-28H,7-10H2,1-6H3/t12-,14+,15-,16+,17-,18-,19+,20-,21+,22+/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H34O8
Molecular Weight 426.5006
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 10 / 10
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:36:34 GMT 2025
Edited
by admin
on Mon Mar 31 22:36:34 GMT 2025
Record UNII
549JG6VN27
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-Deoxyryanodol 10-acetate
Preferred Name English
Cinnzeylanin
Common Name English
Cinnzeylanine
Common Name English
Ryanodol, 3-deoxy-, 10-acetate
Common Name English
6,9-Methanobenzo[1,2]pentaleno[1,6-bc]furan-4,6,7,8a,8b,9a(6aH,9H)-hexol, hexahydro-3,6a,9-trimethyl-7-(1-methylethyl)-, 4-acetate, [3S-(3?,4?,4aS*,6?,6a?,7?,8a?,8b?,9?,9a?)]-
Systematic Name English
6,9-Methanobenzo[1,2]pentaleno[1,6-bc]furan-4,6,7,8a,8b,9a(6aH,9H)-hexol, hexahydro-3,6a,9-trimethyl-7-(1-methylethyl)-, 1-acetate, (3S,4R,4aR,6S,6aS,7S,8aR,8bR,9R,9aS)-
Common Name English
Code System Code Type Description
CAS
62203-47-8
Created by admin on Mon Mar 31 22:36:34 GMT 2025 , Edited by admin on Mon Mar 31 22:36:34 GMT 2025
PRIMARY
FDA UNII
549JG6VN27
Created by admin on Mon Mar 31 22:36:34 GMT 2025 , Edited by admin on Mon Mar 31 22:36:34 GMT 2025
PRIMARY
EPA CompTox
DTXSID801099183
Created by admin on Mon Mar 31 22:36:34 GMT 2025 , Edited by admin on Mon Mar 31 22:36:34 GMT 2025
PRIMARY
PUBCHEM
101306938
Created by admin on Mon Mar 31 22:36:34 GMT 2025 , Edited by admin on Mon Mar 31 22:36:34 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT