Chemical Compound

J1.193.831K

J1.193.831K chemical structure
Primary Record

J1.193.831K

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
177458499
SMILES
C[C@@H]1CC[C@H](O[C@@]12C(OC(O2)(C)C)C(=O)O)[C@H](C)C(C[C@H](CC/C=C/C=C\CC[C@H](C)OC(=O)C3[C@]4(C(CC[C@H](O4)[C@H](C)C(C[C@H](CC/C=C/C=C\CC[C@H](C)O)OCOC)O)C)OC(O3)(C)C)OCOC)O
Canonical SMILES
COCO[C@@H](CC/C=C/C=C\CC[C@H](C)O)CC(O)[C@@H](C)[C@@H]1CCC(C)[C@]2(O1)OC(C)(C)OC2C(=O)O[C@@H](C)CC/C=C\C=C\CC[C@@H](CC(O)[C@@H](C)[C@@H]1CC[C@@H](C)[C@]2(O1)OC(C)(C)OC2C(=O)O)OCOC

Names & Synonyms

  • J1.193.831K
  • (5S,7S)-2,2,10beta-Trimethyl-7alpha-[(1R,4S,7E,9Z,13S)-1-methyl-2-hydroxy-4-(methoxymethoxy)-13-[[(5S,7S)-2,2,10beta-trimethyl-7alpha-[(1R,4S,7E,9Z,13S)-1-methyl-2,13-dihydroxy-4-(methoxymethoxy)-7,9-tetradecadienyl]-1,3,6-trioxaspiro[4.5]decane-4-yl]carbonyloxy]-7,9-tetradecadienyl]-1,3,6-trioxaspiro[4.5]decane-4-carboxylic acid
  • (5S,7S,10R)-7-[(2R,5S,8E,10Z,14S)-14-[(E,Z)-(5S,7S,10R)-7-[(2R,5S,8E,10Z,14S)-3,14-dihydroxy-5-(methoxymethoxy)pentadeca-8,10-dien-2-yl]-2,2,10-trimethyl-1,3,6-trioxaspiro[4.5]decane-4-carbonyloxy]-3-hydroxy-5-(methoxymethoxy)pentadeca-8,10-dien-2-yl]-2,2,10-trimethyl-1,3,6-trioxaspiro[4.5]decane-4-carboxylic acid