Germacra-3,9,11(13)-triene-12,15-dioic acid, 5,6,8-trihydroxy-, 12,8-lactone, methyl ester, 5-acetate 2-chloro-3-hydroxy-2-methylbutyrate
CAS Registry Number®
24694-80-2
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CAS Name
Germacra-3,9,11(13)-triene-12,15-dioic acid, 5,6,8-trihydroxy-, 12,8-lactone, methyl ester, 5-acetate 2-chloro-3-hydroxy-2-methylbutyrateMolecular Formula
C23H29ClO9Molecular Mass
484.92Cite this Page
Germacra-3,9,11(13)-triene-12,15-dioic acid, 5,6,8-trihydroxy-, 12,8-lactone, methyl ester, 5-acetate 2-chloro-3-hydroxy-2-methylbutyrate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=24694-80-2 (retrieved ) (CAS RN: 24694-80-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C23H29ClO9/c1-11-8-7-9-15(21(28)30-6)18(31-14(4)26)19(33-22(29)23(5,24)13(3)25)17-12(2)20(27)32-16(17)10-11/h9-10,13,16-19,25H,2,7-8H2,1,3-6H3
InChIKey
InChIKey=CCVYISFPHKKLEY-UHFFFAOYSA-N
SMILES
O(C(C(C(C)O)(C)Cl)=O)C1C2C(OC(=O)C2=C)C=C(C)CCC=C(C(OC)=O)C1OC(C)=O
Canonical SMILES
O=C(OC)C1=CCCC(=CC2OC(=O)C(=C)C2C(OC(=O)C(Cl)(C)C(O)C)C1OC(=O)C)C
Other Names for this Substance
- Germacra-3,9,11(13)-triene-12,15-dioic acid, 5,6,8-trihydroxy-, 12,8-lactone, methyl ester, 5-acetate 2-chloro-3-hydroxy-2-methylbutyrate
- Butyric acid, 2-chloro-3-hydroxy-2-methyl-, 6-ester with 5,6,8-trihydroxygermacra-3,9,11(13)-triene-12,15-dioic acid 12,8-lactone methyl ester acetate
