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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H34O8
Molecular Weight 486.5541
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of VERRUCARIN K

SMILES

[H][C@]12C[C@H]3O[C@]4([H])C=C(C)CC[C@]4(COC(=O)[C@@H](O)[C@H](C)CCOC(=O)\C=C\C=CC(=O)O1)[C@]2(C)C3=C

InChI

InChIKey=TVDLZHBXZUICCI-DDXUFAKYSA-N
InChI=1S/C27H34O8/c1-16-9-11-27-15-33-25(31)24(30)17(2)10-12-32-22(28)7-5-6-8-23(29)35-20-14-19(34-21(27)13-16)18(3)26(20,27)4/h5-8,13,17,19-21,24,30H,3,9-12,14-15H2,1-2,4H3/b7-5+,8-6-/t17-,19-,20-,21-,24+,26-,27-/m1/s1

HIDE SMILES / InChI

Molecular Formula C27H34O8
Molecular Weight 486.5541
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:35:09 GMT 2023
Edited
by admin
on Sat Dec 16 09:35:09 GMT 2023
Record UNII
4T60YRT2TG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
VERRUCARIN K
MI  
Common Name English
VERRUCARIN K [MI]
Common Name English
VERRUCARIN A, 12,13-DEEPOXY-12,13-DIDEHYDRO-
Common Name English
12,13-DEEPOXY-12,13-DIDEHYDROVERRUCARIN A
Common Name English
Code System Code Type Description
CAS
63739-93-5
Created by admin on Sat Dec 16 09:35:09 GMT 2023 , Edited by admin on Sat Dec 16 09:35:09 GMT 2023
PRIMARY
MERCK INDEX
m11430
Created by admin on Sat Dec 16 09:35:09 GMT 2023 , Edited by admin on Sat Dec 16 09:35:09 GMT 2023
PRIMARY Merck Index
PUBCHEM
90474308
Created by admin on Sat Dec 16 09:35:09 GMT 2023 , Edited by admin on Sat Dec 16 09:35:09 GMT 2023
PRIMARY
FDA UNII
4T60YRT2TG
Created by admin on Sat Dec 16 09:35:09 GMT 2023 , Edited by admin on Sat Dec 16 09:35:09 GMT 2023
PRIMARY