(Q105150354)

English

[(2S,4aR,6R,7R)-6-acetyloxy-7-(3-methoxy-3-oxoprop-1-en-2-yl)-1,4a-dimethyl-3,4,5,6,7,8-hexahydro-2H-naphthalen-2-yl] (E)-3-methylpent-2-enoate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

[6-acetyloxy-7-(3-methoxy-3-oxoprop-1-en-2-yl)-1,4a-dimethyl-3,4,5,6,7,8-hexahydro-2H-naphthalen-2-yl] 3-methylpent-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

418.235538808 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₄H₃₄O₆

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canonical SMILES

O=C(OC1C(=C2CC(C(=C)C(=O)OC)C(OC(=O)C)CC2(C)CC1)C)C=C(C)CC

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isomeric SMILES

C=C(C(=O)OC)[C@H]1CC2=C(C)[C@@H](OC(=O)/C=C(\C)CC)CC[C@]2(C)C[C@H]1OC(C)=O

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found in taxon

Eriocephalus pauperrimus

1 reference

stated in

Sesquiterpene lactones and other constituents from Eriocephalus species

Identifiers

InChI

InChI=1S/C24H34O6/c1-8-14(2)11-22(26)30-20-9-10-24(6)13-21(29-17(5)25)18(12-19(24)16(20)4)15(3)23(27)28-7/h11,18,20-21H,3,8-10,12-13H2,1-2,4-7H3/b14-11+/t18-,20+,21-,24-/m1/s1

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InChIKey

LDRZYGUMWIDMBB-MWLMASHZSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

LDRZYGUMWIDMBB-MWLMASHZSA-N

(Q105150354)

[(2S,4aR,6R,7R)-6-acetyloxy-7-(3-methoxy-3-oxoprop-1-en-2-yl)-1,4a-dimethyl-3,4,5,6,7,8-hexahydro-2H-naphthalen-2-yl] (E)-3-methylpent-2-enoate

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Identifiers

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