(Q105156359)

English

(3S)-5-[(3S,6aR,7S,8R,10aS)-3-methoxy-7,8-dimethyl-1,3,5,6,6a,8,9,10-octahydrobenzo[d][2]benzofuran-7-yl]-3-methylpentanoic acid

chemical compound

In more languages

default for all languages

No label defined

No description defined

Statements

type of chemical entity

0 references

5-(3-Methoxy-7,8-dimethyl-1,3,5,6,6a,8,9,10-octahydrobenzo[d][2]benzofuran-7-yl)-3-methylpentanoic acid

1 reference

based on heuristic

inferred from SMILES

350.245709568 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₁H₃₄O₄

0 references

canonical SMILES

O=C(O)CC(C)CCC1(C)C(C)CCC23C(=CCCC21)C(OC)OC3

0 references

isomeric SMILES

CO[C@H]1OC[C@@]23CC[C@@H](C)[C@](C)(CC[C@H](C)CC(=O)O)[C@H]2CCC=C13

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Olearia teretifolia

1 reference

Clerodane and labdane derivatives from Olearia teretifolia

Identifiers

InChI=1S/C21H34O4/c1-14(12-18(22)23)8-10-20(3)15(2)9-11-21-13-25-19(24-4)16(21)6-5-7-17(20)21/h6,14-15,17,19H,5,7-13H2,1-4H3,(H,22,23)/t14-,15+,17+,19-,20-,21+/m0/s1

0 references

LRWCMEOTIOLGOG-IZSOANEVSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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