(Q105181599)

English

(E)-5-[(1R,2S,4aS,8aS)-1,2,4a,5-tetramethyl-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

0 references

subclass of

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

1 reference

based on heuristic

inferred from SMILES

mass

304.240230264 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

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

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

3-Methyl-5-(1,2,4a,5-tetramethyl-1,2,3,4,4a,7,8,8a-octahydro-naphthalen-1-yl)-pent-2-enoic acid

1 reference

1 reference

C₂₀H₃₂O₂

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canonical SMILES

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

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isomeric SMILES

CC1=CCC[C@@H]2[C@]1(C)CC[C@H](C)[C@@]2(C)CC/C(C)=C/C(=O)O

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found in taxon

Sindora sumatrana

1 reference

stated in

Constituents of Sindora sumatrana MIQ. III. New trans-Clerodane Diterpenoids from the Dried Pods.

Identifiers

InChI

InChI=1S/C20H32O2/c1-14(13-18(21)22)9-11-19(4)16(3)10-12-20(5)15(2)7-6-8-17(19)20/h7,13,16-17H,6,8-12H2,1-5H3,(H,21,22)/b14-13+/t16-,17-,19+,20+/m0/s1

0 references

InChIKey

NLVMTSRTOGOFQD-OBEVQLELSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

NLVMTSRTOGOFQD-OBEVQLELSA-N

(Q105181599)

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

Statements

Identifiers

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