(Q105350675)

English

(3bR,5aS,9aS,9bR)-3b,6,6,9a-tetramethyl-3b,4,5,5a,6,7,8,9,9a,9b,10,11-dodecahydrophenanthro[1,2-c]furan

chemical compound

In more languages

Statements

type of chemical entity

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isocopalane diterpenoid

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286.22966558 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₃₀O

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canonical SMILES

O1C=C2C(=C1)C3(C)CCC4C(C)(C)CCCC4(C)C3CC2

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isomeric SMILES

CC1(C)CCC[C@@]2(C)[C@H]1CC[C@@]1(C)c3cocc3CC[C@H]21

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1 reference

Spongian diterpenes with thyrotropin releasing hormone receptor 2 binding affinity from Spongia sp.

Identifiers

InChI=1S/C20H30O/c1-18(2)9-5-10-20(4)16(18)8-11-19(3)15-13-21-12-14(15)6-7-17(19)20/h12-13,16-17H,5-11H2,1-4H3/t16-,17-,19-,20-/m0/s1

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YMOPWLIPDPZTLZ-ZULIPRJHSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

UniChem compound ID

1 reference

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