Butanoic acid, 3-chloro-2-hydroxy-2-methyl-, 2,4,4a,5,6,7,8,8a,9,9a-decahydro-6-hydroxy-3,4a,5-trimethyl-2-oxonaphtho[2,3-b]furan-4-yl ester
CAS Registry Number®
171422-90-5
CAS Name
Butanoic acid, 3-chloro-2-hydroxy-2-methyl-, 2,4,4a,5,6,7,8,8a,9,9a-decahydro-6-hydroxy-3,4a,5-trimethyl-2-oxonaphtho[2,3-b]furan-4-yl esterMolecular Formula
C20H29ClO6Molecular Mass
400.89Cite this Page
Butanoic acid, 3-chloro-2-hydroxy-2-methyl-, 2,4,4a,5,6,7,8,8a,9,9a-decahydro-6-hydroxy-3,4a,5-trimethyl-2-oxonaphtho[2,3-b]furan-4-yl ester. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=171422-90-5 (retrieved ) (CAS RN: 171422-90-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C20H29ClO6/c1-9-15-14(26-17(9)23)8-12-6-7-13(22)10(2)19(12,4)16(15)27-18(24)20(5,25)11(3)21/h10-14,16,22,25H,6-8H2,1-5H3/t10-,11?,12+,13-,14+,16+,19+,20?/m0/s1
InChIKey
InChIKey=GDXCVSFALPNRCV-TZYMSFHESA-N
SMILES
O(C(C(C(C)Cl)(C)O)=O)[C@H]1[C@@]2(C)[C@@](C[C@@]3(C1=C(C)C(=O)O3)[H])(CC[C@H](O)[C@@H]2C)[H]
Canonical SMILES
O=C1OC2C(=C1C)C(OC(=O)C(O)(C)C(Cl)C)C3(C)C(C)C(O)CCC3C2
Other Names for this Substance
- Butanoic acid, 3-chloro-2-hydroxy-2-methyl-, 2,4,4a,5,6,7,8,8a,9,9a-decahydro-6-hydroxy-3,4a,5-trimethyl-2-oxonaphtho[2,3-b]furan-4-yl ester