(Q105128886)

English

(1R,4aS,4bS,6R,7S,10aR)-7-ethenyl-6-hydroxy-1-(hydroxymethyl)-1,4a,7-trimethyl-3,4,4b,5,6,9,10,10a-octahydrophenanthren-2-one

chemical compound

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instance of

type of chemical entity

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subclass of

7-Ethenyl-6-hydroxy-1-(hydroxymethyl)-1,4a,7-trimethyl-3,4,4b,5,6,9,10,10a-octahydrophenanthren-2-one

1 reference

based on heuristic

inferred from SMILES

mass

318.21949482 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₃₀O₃

0 references

canonical SMILES

O=C1CCC2(C)C3C(=CC(C=C)(C)C(O)C3)CCC2C1(C)CO

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isomeric SMILES

C=C[C@@]1(C)C=C2CC[C@@H]3[C@@](C)(CCC(=O)[C@@]3(C)CO)[C@H]2C[C@H]1O

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found in taxon

Sapium haematospermum

3 references

stated in

Mycobacterium tuberculosis growth inhibition by constituents of Sapium haematospermum

stated in

Mycobacterium tuberculosis growth inhibition by constituents of Sapium haematospermum

stated in

Mycobacterium tuberculosis growth inhibition by constituents of Sapium haematospermum

Identifiers

InChI

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

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InChIKey

JIBFELDYWDCIJI-GJRGARDJSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

JIBFELDYWDCIJI-GJRGARDJSA-N

1 reference

(Q105128886)

(1R,4aS,4bS,6R,7S,10aR)-7-ethenyl-6-hydroxy-1-(hydroxymethyl)-1,4a,7-trimethyl-3,4,4b,5,6,9,10,10a-octahydrophenanthren-2-one

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