Chemical Compound

CHEBI:224625

CHEBI:224625 chemical structure
Primary Record

CHEBI:224625

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
156580558
SMILES
CC[C@@H]1C[C@]23C(=C(C(=O)O2)OC(=O)[C@]4([C@@H]5CC[C@@H]([C@@H]([C@H]5C=C([C@H]4CCCC[C@@]3(C=C1C(=O)O)C)C)O[C@H]6[C@H]([C@H]([C@H](C(O6)C)OC(=O)C7=C(C=CC=C7OC)C)O[C@H]8C[C@H]([C@H]([C@H](O8)C)OC)O)O)O)C)O
Canonical SMILES
CC[C@@H]1C[C@@]23OC(=O)C(=C2O)OC(=O)[C@]2(C)[C@H](CCCC[C@]3(C)C=C1C(=O)O)C(C)=C[C@@H]1[C@@H](O[C@@H]3OC(C)[C@H](OC(=O)c4c(C)cccc4OC)[C@H](O[C@H]4C[C@@H](O)[C@@H](OC)[C@@H](C)O4)[C@@H]3O)[C@@H](O)CC[C@H]12

Names & Synonyms

  • CHEBI:224625
  • PA-46101 A
  • (1S,3R,6R,11R,14S,15R,16S,19R,20S)-3-ethyl-16,26-dihydroxy-15-[(2S,3S,4R,5S)-3-hydroxy-4-[(2S,4R,5R,6R)-4-hydroxy-5-methoxy-6-methyloxan-2-yl]oxy-5-(2-methoxy-6-methylbenzoyl)oxy-6-methyloxan-2-yl]oxy-6,12,20-trimethyl-21,24-dioxo-22,25-dioxapentacyclo[21.2.1.01,6.011,20.014,19]hexacosa-4,12,23(26)-triene-4-carboxylic acid