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Details

Stereochemistry ABSOLUTE
Molecular Formula C30H48O6
Molecular Weight 504.6985
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CLETHRIC ACID

SMILES

C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@@H](O)C(CO)(CO)[C@@H]5CC[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O

InChI

InChIKey=MDDPTIWFHAUVPJ-YIHHDBOSSA-N
InChI=1S/C30H48O6/c1-18-8-13-29(24(34)35)15-14-26(3)19(23(29)28(18,5)36)6-7-20-25(2)11-10-22(33)30(16-31,17-32)21(25)9-12-27(20,26)4/h6,18,20-23,31-33,36H,7-17H2,1-5H3,(H,34,35)/t18-,20-,21-,22-,23-,25-,26-,27-,28-,29+/m1/s1

HIDE SMILES / InChI

Molecular Formula C30H48O6
Molecular Weight 504.6985
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 22:58:41 GMT 2025
Edited
by admin
on Mon Mar 31 22:58:41 GMT 2025
Record UNII
2IL807ME4O
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
URS-12-EN-28-OIC ACID, 3,19,23,24-TETRAHYDROXY-, (3.ALPHA.)-
Preferred Name English
CLETHRIC ACID
Common Name English
Code System Code Type Description
FDA UNII
2IL807ME4O
Created by admin on Mon Mar 31 22:58:41 GMT 2025 , Edited by admin on Mon Mar 31 22:58:41 GMT 2025
PRIMARY
PUBCHEM
20055826
Created by admin on Mon Mar 31 22:58:41 GMT 2025 , Edited by admin on Mon Mar 31 22:58:41 GMT 2025
PRIMARY
CAS
68800-57-7
Created by admin on Mon Mar 31 22:58:41 GMT 2025 , Edited by admin on Mon Mar 31 22:58:41 GMT 2025
PRIMARY