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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H38O8
Molecular Weight 454.5537
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RHODOJAPONIN IV

SMILES

[H][C@@]1(OC(C)=O)[C@H]2CC[C@]3([H])[C@@]1(C[C@@]2(C)O)C[C@@H](OC(C)=O)[C@@]4(O)[C@@]([H])(C[C@H](O)C4(C)C)[C@]3(C)O

InChI

InChIKey=CLACQPZPBZLUQK-ZQSAPXNLSA-N
InChI=1S/C24H38O8/c1-12(25)31-18-10-23-11-21(5,28)14(19(23)32-13(2)26)7-8-15(23)22(6,29)16-9-17(27)20(3,4)24(16,18)30/h14-19,27-30H,7-11H2,1-6H3/t14-,15+,16+,17+,18-,19-,21-,22-,23+,24+/m1/s1

HIDE SMILES / InChI

Molecular Formula C24H38O8
Molecular Weight 454.5537
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 Sat Dec 16 08:26:50 GMT 2023
Edited
by admin
on Sat Dec 16 08:26:50 GMT 2023
Record UNII
7856J6T1U3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RHODOJAPONIN IV
Common Name English
6-O-ACETYLGRAYANOTOXIN I
Common Name English
GRAYANOTOXANE-3,5,6,10,14,16-HEXOL, 6,14-DIACETATE, (3.BETA.,6.BETA.,14R)-
Systematic Name English
GRAYANOTOXIN III 6,14-DIACETATE
Common Name English
Code System Code Type Description
CAS
30460-34-5
Created by admin on Sat Dec 16 08:26:50 GMT 2023 , Edited by admin on Sat Dec 16 08:26:50 GMT 2023
PRIMARY
PUBCHEM
442083
Created by admin on Sat Dec 16 08:26:50 GMT 2023 , Edited by admin on Sat Dec 16 08:26:50 GMT 2023
PRIMARY
EPA CompTox
DTXSID10952788
Created by admin on Sat Dec 16 08:26:50 GMT 2023 , Edited by admin on Sat Dec 16 08:26:50 GMT 2023
PRIMARY
FDA UNII
7856J6T1U3
Created by admin on Sat Dec 16 08:26:50 GMT 2023 , Edited by admin on Sat Dec 16 08:26:50 GMT 2023
PRIMARY