Description:
Dihydroajugapitin is a diterpenoid compound isolated from the herbs of Ajuga ciliata Bunge.
- Molecular Weight: 552.7
- Molecular Formula: C29H44O10
Purity: 97.5%
Canonical SMILES:
CCC(C)C(=O)OC1C(CC2C(C(CC(C2(C13CO3)COC(=O)C)OC(=O)C)C)(C)C4CC5CCOC5O4)O
InChI:
InChI=1S/C29H44O10/c1-7-15(2)25(33)39-24-20(32)12-21-27(6,22-11-19-8-9-34-26(19)38-22)16(3)10-23(37-18(5)31)28(21,13-35-17(4)30)29(24)14-36-29/h15-16,19-24,26,32H,7-14H2,1-6H3/t15-,16+,19+,20+,21+,22-,23-,24-,26-,27-,28-,29+/m0/s1
InChIKey: XMVULWKEVGKECE-JORUAPMBSA-N
- Boiling Point: 611.7±55.0 °C(Predicted)
- Appearance: Powder
Synonyms:
14,15-Dihydroajugapitin; (1R,2S,3R,4aR,5S,6R,8S,8aR)-8-Acetoxy-8a-(acetoxymethyl)-5-[(2S,3aR,6aS)-hexahydrofuro[2,3-b]furan-2-yl]-3-hydroxy-5,6-dimethyloctahydro-2H-spiro[naphthalene-1,2'-oxiran]-2-yl (2S)-2-methylbutanoate
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