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Details

Stereochemistry ACHIRAL
Molecular Formula C21H22O6
Molecular Weight 370.3958
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MOLLICELLIN I

SMILES

CC(C)=CCC1=C(O)C=C2OC3=C(CO)C(O)=CC(C)=C3C(=O)OC2=C1C

InChI

InChIKey=NTWOSLVOKRNGLX-UHFFFAOYSA-N
InChI=1S/C21H22O6/c1-10(2)5-6-13-12(4)19-17(8-16(13)24)26-20-14(9-22)15(23)7-11(3)18(20)21(25)27-19/h5,7-8,22-24H,6,9H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C21H22O6
Molecular Weight 370.3958
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:28:38 GMT 2023
Edited
by admin
on Sat Dec 16 08:28:38 GMT 2023
Record UNII
ALX4O68IJZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MOLLICELLIN I
Common Name English
11H-DIBENZO(B,E)(1,4)DIOXEPIN-11-ONE, 3,7-DIHYDROXY-4-(HYDROXYMETHYL)-1,9-DIMETHYL-8-(3-METHYL-2-BUTEN-1-YL)-
Systematic Name English
Code System Code Type Description
PUBCHEM
24787299
Created by admin on Sat Dec 16 08:28:38 GMT 2023 , Edited by admin on Sat Dec 16 08:28:38 GMT 2023
PRIMARY
FDA UNII
ALX4O68IJZ
Created by admin on Sat Dec 16 08:28:38 GMT 2023 , Edited by admin on Sat Dec 16 08:28:38 GMT 2023
PRIMARY
CAS
1016605-29-0
Created by admin on Sat Dec 16 08:28:38 GMT 2023 , Edited by admin on Sat Dec 16 08:28:38 GMT 2023
PRIMARY