(Q105168541)

English

(E,4R)-5-[(1S,2R,4aR,8aR)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpent-2-ene-1,4-diol

chemical compound

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instance of

type of chemical entity

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subclass of

5-(1,2,4a,5-Tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl)-3-methylpent-2-ene-1,4-diol

1 reference

based on heuristic

inferred from SMILES

mass

306.255880328 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₃₄O₂

0 references

canonical SMILES

OCC=C(C)C(O)CC1(C)C(C)CCC2(C(=CCCC21)C)C

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isomeric SMILES

CC1=CCC[C@@H]2[C@@](C)(C[C@@H](O)/C(C)=C/CO)[C@H](C)CC[C@@]12C

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found in taxon

Cipadessa baccifera

1 reference

stated in

Diterpenes from Cipadessa fruticosa

Identifiers

InChI

InChI=1S/C20H34O2/c1-14(10-12-21)17(22)13-20(5)16(3)9-11-19(4)15(2)7-6-8-18(19)20/h7,10,16-18,21-22H,6,8-9,11-13H2,1-5H3/b14-10+/t16-,17-,18+,19+,20+/m1/s1

0 references

InChIKey

MNRGUPHQEVIYLM-ZNBWTZMLSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

MNRGUPHQEVIYLM-ZNBWTZMLSA-N

(Q105168541)

(E,4R)-5-[(1S,2R,4aR,8aR)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpent-2-ene-1,4-diol

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Identifiers

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