(Q105256199)

English

(1S)-1-[(2R,4aS,4bR,7R,8R,8aS)-7-hydroxy-8-(hydroxymethyl)-2,4b,8-trimethyl-3,4,4a,5,6,7,8a,9-octahydro-1H-phenanthren-2-yl]ethane-1,2-diol

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

1-[7-hydroxy-8-(hydroxymethyl)-2,4b,8-trimethyl-3,4,4a,5,6,7,8a,9-octahydro-1H-phenanthren-2-yl]ethane-1,2-diol

1 reference

based on heuristic

inferred from SMILES

mass

338.245709568 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1S)-1-[(2S,4aR,4bS,7S,8S,8aS)-7-hydroxy-8-(hydroxymethyl)-2,4b,8-trimethyl-3,4,4a,5,6,7,8a,9-octahydro-1H-phenanthren-2-yl]ethane-1,2-diol

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₃₄O₄

0 references

canonical SMILES

OCC(O)C1(C)CC2=CCC3C(C)(CO)C(O)CCC3(C)C2CC1

0 references

isomeric SMILES

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

0 references

found in taxon

Palafoxia rosea

1 reference

stated in

Neue labdan- und pimaren-derivate aus Palafoxia rosea

Identifiers

InChI

InChI=1S/C20H34O4/c1-18(17(24)11-21)8-6-14-13(10-18)4-5-15-19(14,2)9-7-16(23)20(15,3)12-22/h4,14-17,21-24H,5-12H2,1-3H3/t14-,15-,16+,17+,18+,19+,20-/m0/s1

0 references

InChIKey

SMWFFXGYNIDWPX-BKFJMFTRSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

SMWFFXGYNIDWPX-BKFJMFTRSA-N

(Q105256199)

(1S)-1-[(2R,4aS,4bR,7R,8R,8aS)-7-hydroxy-8-(hydroxymethyl)-2,4b,8-trimethyl-3,4,4a,5,6,7,8a,9-octahydro-1H-phenanthren-2-yl]ethane-1,2-diol

Statements

Identifiers

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