(Q105240935)

English

(4R)-6-[(1R,2R,4aS,8aS)-2-hydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-4-methylhexanoic acid

chemical compound

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instance of

type of chemical entity

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subclass of

6-(2-hydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-4-methylhexanoic acid

1 reference

based on heuristic

inferred from SMILES

mass

338.282095076 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₁H₃₈O₃

0 references

canonical SMILES

O=C(O)CCC(C)CCC1C(O)(C)CCC2C(C)(C)CCCC12C

0 references

isomeric SMILES

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

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found in taxon

Cistus monspeliensis

1 reference

stated in

Etude chimio-taxonomique dans le genre cistus

Identifiers

InChI

InChI=1S/C21H38O3/c1-15(8-10-18(22)23)7-9-17-20(4)13-6-12-19(2,3)16(20)11-14-21(17,5)24/h15-17,24H,6-14H2,1-5H3,(H,22,23)/t15-,16+,17-,20+,21-/m1/s1

0 references

InChIKey

RMOANDLRKRTOAX-BPERIUBUSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

RMOANDLRKRTOAX-BPERIUBUSA-N

(Q105240935)

(4R)-6-[(1R,2R,4aS,8aS)-2-hydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-4-methylhexanoic acid

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