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Chemical structure of Siraitic Acid A

GC37640

Siraitic Acid A

Also known as (E,6R)-6-[(1R,4S,5S,8R,9R,12R,13S,16S,17S)-16-hydroxy-5,9,17-trimethyl-11-oxo-18-oxapentacyclo[10.5.2.01,13.04,12.05,9]nonadecan-8-yl]-2-methylhept-2-enoic acid

Siraitic Acid A is a cucurbitane triterpenoid isolated from the root of S· grosvenori

ChemicalCAS183374-15-4MW472.66FormulaC29H44O5
CAS number
183374-15-4
Molecular weight
472.66
Formula
C29H44O5
Solubility
Soluble in DMSO
InChIKey
BGEBMNJNYRCNCU-RIPWTOCISA-N
Catalogue number
GC37640
Brand
GLPBIO
Computed properties PubChem CID 138911439 · XLogP 5.1 · TPSA 83.8 Ų · H-bond donors 2
XLogP
5.1
TPSA
83.8 Ų
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
34

SMILES C[C@H]1[C@H](CC[C@@H]2[C@]13CC[C@@H]4[C@@]2(CO3)C(=O)C[C@]5([C@]4(CC[C@@H]5[C@H](C)CC/C=C(\C)/C(=O)O)C)C)O

Computed descriptors from PubChem (CID 138911439), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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