(Q105260964)

English

(E)-5-[(1S,2R,4aS,8aR)-4a,5-bis(hydroxymethyl)-1,2-dimethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpent-2-enoic acid

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

5-[4a,5-Bis(hydroxymethyl)-1,2-dimethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpent-2-enoic acid

1 reference

based on heuristic

inferred from SMILES

mass

336.230059504 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₃₂O₄

0 references

canonical SMILES

O=C(O)C=C(C)CCC1(C)C(C)CCC2(C(=CCCC21)CO)CO

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isomeric SMILES

C/C(=C\C(=O)O)CC[C@@]1(C)[C@H](C)CC[C@@]2(CO)C(CO)=CCC[C@@H]21

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found in taxon

Olearia teretifolia

1 reference

stated in

Clerodane and labdane derivatives from Olearia teretifolia

Identifiers

InChI

InChI=1S/C20H32O4/c1-14(11-18(23)24)7-9-19(3)15(2)8-10-20(13-22)16(12-21)5-4-6-17(19)20/h5,11,15,17,21-22H,4,6-10,12-13H2,1-3H3,(H,23,24)/b14-11+/t15-,17-,19+,20-/m1/s1

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InChIKey

SUIJWPJRFXANRY-SYNBHEIUSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

SUIJWPJRFXANRY-SYNBHEIUSA-N

(Q105260964)

(E)-5-[(1S,2R,4aS,8aR)-4a,5-bis(hydroxymethyl)-1,2-dimethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpent-2-enoic acid

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Identifiers

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