(Q105194039)

English

Scuterivulactone D

chemical compound

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Statements

type of chemical entity

0 references

[3,7,8-trihydroxy-3,4,8,8a-tetramethyl-4-[2-(5-oxo-2H-furan-3-yl)ethenyl]-1,2,4a,5,6,7-hexahydronaphthalen-1-yl] benzoate

1 reference

based on heuristic

inferred from SMILES

470.230453428 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(1S,3S,4S,4aR,7R,8R,8aS)-3,7,8-trihydroxy-3,4,8,8a-tetramethyl-4-[(E)-2-(5-oxo-2H-furan-3-yl)ethenyl]-1,2,4a,5,6,7-hexahydronaphthalen-1-yl] benzoate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₇H₃₄O₇

0 references

canonical SMILES

O=C1OCC(C=CC2(C)C3CCC(O)C(O)(C)C3(C)C(OC(=O)C=4C=CC=CC4)CC2(O)C)=C1

0 references

isomeric SMILES

C[C@@]12[C@@H](OC(=O)c3ccccc3)C[C@](C)(O)[C@](C)(/C=C/C3=CC(=O)OC3)[C@H]1CC[C@@H](O)[C@]2(C)O

0 references

Scutellaria rivularis

10 references

Studies on the Constituents of Scutellaria Species. XVIII. Structures of Neoclerodane-Type Diterpenoids from the Whole Herb of Scutellaria rivularis WALL.

Structure of scuterivulactone D determined by two-dimensional NMR spectroscopy. A new diterpenoid from a chinese crude drug "Ban Zhi Lian" (Scutellaria rivularis Wall.).

Structures of scutellones D and E determined from X-ray diffraction, spectral and chemical evidence. Neoclerodane-type diterpenoids from scutellaria rivularis WALL.

Scutellaric acid, a new triterpene from Scutellaria rivularis.

Studies on the Constituents of Scutellaria Species. XVIII. Structures of Neoclerodane-Type Diterpenoids from the Whole Herb of Scutellaria rivularis WALL.

Studies on the Constituents of Scutellaria Species. XVIII. Structures of Neoclerodane-Type Diterpenoids from the Whole Herb of Scutellaria rivularis WALL.

Structure of scuterivulactone D determined by two-dimensional NMR spectroscopy. A new diterpenoid from a chinese crude drug "Ban Zhi Lian" (Scutellaria rivularis Wall.).

Structures of scutellones D and E determined from X-ray diffraction, spectral and chemical evidence. Neoclerodane-type diterpenoids from scutellaria rivularis WALL.

Scutellone C and F, Two New Neoclerodane Type Diterpenoids from Scutellaria rivularis

Structure of scuterivulactone D determined by two-dimensional NMR spectroscopy. A new diterpenoid from a chinese crude drug "Ban Zhi Lian" (Scutellaria rivularis Wall.).

Scutellaria barbata

5 references

Scutellaric acid, a new triterpene from Scutellaria rivularis.

Scutellone C and F, Two New Neoclerodane Type Diterpenoids from Scutellaria rivularis

Studies on the Constituents of Scutellaria Species. XVIII. Structures of Neoclerodane-Type Diterpenoids from the Whole Herb of Scutellaria rivularis WALL.

Structures of scutellones D and E determined from X-ray diffraction, spectral and chemical evidence. Neoclerodane-type diterpenoids from scutellaria rivularis WALL.

Structure of scuterivulactone D determined by two-dimensional NMR spectroscopy. A new diterpenoid from a chinese crude drug "Ban Zhi Lian" (Scutellaria rivularis Wall.).

Identifiers

InChI=1S/C27H34O7/c1-24(13-12-17-14-22(29)33-16-17)19-10-11-20(28)27(4,32)26(19,3)21(15-25(24,2)31)34-23(30)18-8-6-5-7-9-18/h5-9,12-14,19-21,28,31-32H,10-11,15-16H2,1-4H3/b13-12+/t19-,20-,21+,24-,25+,26+,27+/m1/s1

0 references

OLMPIDWZCBHRNQ-VBCSIWJFSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

UniChem compound ID

1 reference

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