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Details

Stereochemistry UNKNOWN
Molecular Formula C16H25NO5
Molecular Weight 311.3734
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Crocandine

SMILES

CC1C(=O)OCC2CCN3CCC(OC(=O)C(C)C1(C)O)C23

InChI

InChIKey=HUXORIJETCKEAL-UHFFFAOYSA-N
InChI=1S/C16H25NO5/c1-9-14(18)21-8-11-4-6-17-7-5-12(13(11)17)22-15(19)10(2)16(9,3)20/h9-13,20H,4-8H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C16H25NO5
Molecular Weight 311.3734
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:23:07 GMT 2025
Edited
by admin
on Mon Mar 31 23:23:07 GMT 2025
Record UNII
GPG59QQE6Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2H-[1,6]Dioxacycloundecino[2,3,4-gh]pyrrolizine-2,6(3H)-dione, decahydro-4-hydroxy-3,4,5-trimethyl-, (8aR,13aR,13bR)-
Preferred Name English
Crocandine
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID20993647
Created by admin on Mon Mar 31 23:23:07 GMT 2025 , Edited by admin on Mon Mar 31 23:23:07 GMT 2025
PRIMARY
CAS
72855-83-5
Created by admin on Mon Mar 31 23:23:07 GMT 2025 , Edited by admin on Mon Mar 31 23:23:07 GMT 2025
PRIMARY
PUBCHEM
156034
Created by admin on Mon Mar 31 23:23:07 GMT 2025 , Edited by admin on Mon Mar 31 23:23:07 GMT 2025
PRIMARY
FDA UNII
GPG59QQE6Z
Created by admin on Mon Mar 31 23:23:07 GMT 2025 , Edited by admin on Mon Mar 31 23:23:07 GMT 2025
PRIMARY