(Q105349867)

English

(5beta,9beta,10alpha,13beta)-3alpha,7beta,17,19-Tetrahydroxyabieta-8(14),15-diene

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

1-(Hydroxymethyl)-7-(3-hydroxyprop-1-en-2-yl)-1,4a-dimethyl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-2,9-diol

1 reference

based on heuristic

inferred from SMILES

mass

336.230059504 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1R,2S,4aR,4bR,7S,9R,10aR)-1-(hydroxymethyl)-7-(3-hydroxyprop-1-en-2-yl)-1,4a-dimethyl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-2,9-diol

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₃₂O₄

0 references

canonical SMILES

OCC(=C)C1C=C2C(O)CC3C(C)(CO)C(O)CCC3(C)C2CC1

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isomeric SMILES

C=C(CO)[C@H]1C=C2[C@@H](O)C[C@H]3[C@@](C)(CC[C@@H](O)[C@]3(C)CO)[C@@H]2CC1

0 references

found in taxon

Isodon parvifolius

1 reference

stated in

Ent-abietane and ent-labdane diterpenoids from Isodon parvifolius

Isodon rubescens

2 references

stated in

Newent-Abietanoids fromIsodon rubescens

stated in

ent-Abietane diterpenoids from Isodon rubescens var. rubescens.

Identifiers

InChI

InChI=1S/C20H32O4/c1-12(10-21)13-4-5-15-14(8-13)16(23)9-17-19(15,2)7-6-18(24)20(17,3)11-22/h8,13,15-18,21-24H,1,4-7,9-11H2,2-3H3/t13-,15-,16+,17+,18-,19+,20-/m1/s1

0 references

InChIKey

YKSOUKMSKAWWQG-SBSFFHCLSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YKSOUKMSKAWWQG-SBSFFHCLSA-N

1 reference

(Q105349867)

(5beta,9beta,10alpha,13beta)-3alpha,7beta,17,19-Tetrahydroxyabieta-8(14),15-diene

Statements

Identifiers

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