(Q105202806)

English

(2R,4aR,4bS,8aS,9R)-2-ethenyl-9-hydroxy-4b-(hydroxymethyl)-2,8,8-trimethyl-3,4,4a,5,6,7,8a,9-octahydrophenanthren-1-one

chemical compound

In more languages

Statements

type of chemical entity

0 references

1 reference

based on heuristic

inferred from SMILES

2-Ethenyl-9-hydroxy-4b-(hydroxymethyl)-2,8,8-trimethyl-3,4,4a,5,6,7,8a,9-octahydrophenanthren-1-one

1 reference

based on heuristic

inferred from SMILES

318.21949482 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₃₀O₃

0 references

canonical SMILES

O=C1C2=CC(O)C3C(C)(C)CCCC3(CO)C2CCC1(C=C)C

0 references

isomeric SMILES

C=C[C@@]1(C)CC[C@H]2C(=C[C@@H](O)[C@H]3C(C)(C)CCC[C@@]32CO)C1=O

0 references

1 reference

Anti-inflammatory diterpenes from the seeds of Vitex negundo

Identifiers

InChI=1S/C20H30O3/c1-5-19(4)10-7-14-13(17(19)23)11-15(22)16-18(2,3)8-6-9-20(14,16)12-21/h5,11,14-16,21-22H,1,6-10,12H2,2-4H3/t14-,15+,16-,19-,20-/m0/s1

0 references

OXNXVJIOIKYEAC-MHZKCTCGSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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