2,3-O-Isopropylidene-L-apiose

Product Specifications

CAS Number

70147-51-2

Synonyms

2,3-O-(1-Methylethylidene)-L-apiose; 5,5-bis(Hydroxymethyl)-2,2-dimethyl-1,3-dioxolane-4-carbaldehyde

Hazard Statement

No Data Available

Smiles

CC[C@@H](C(C)C)[C@@H](O)[C@H](O)[C@H](C)[C@H]1CC[C@@H]2[C@@H]3COC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@@H]3CC[C@]12C

Molecular Formula

C29 H50 O6

Molecular Weight

494.704

InChI

InChI=1S/C29H50O6/c1-7-17(15(2)3)26(33)25(32)16(4)19-8-9-20-18-14-35-27(34)22-12-23(30)24(31)13-29(22,6)21(18)10-11-28(19,20)5/h15-26,30-33H,7-14H2,1-6H3/t16-,17+,18+,19-,20-,21-,22+,23-,24+,25-,26-,28-,29-/m1/s1

Additionnal Information

IUPAC name: (1R,2R,4S,5R,7R,11S,12R,15R,16S)-15-[(2R,3R,4R,5S)-5-ethyl-3,4-dihydroxy-6-methylheptan-2-yl]-4,5-dihydroxy-2,16-dimethyl-9-oxatetracyclo[9.7.0.02,7.012,16]octadecan-8-one