(Q105312587)

English

[(1S,4aS,5R,6R,8aR)-6-hydroxy-1,4a,6-trimethyl-5-(3-methylidenepent-4-enyl)-3,4,5,7,8,8a-hexahydro-2H-naphthalen-1-yl]methyl (Z)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

chemical compound

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instance of

type of chemical entity

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subclass of

[6-hydroxy-1,4a,6-trimethyl-5-(3-methylidenepent-4-enyl)-3,4,5,7,8,8a-hexahydro-2H-naphthalen-1-yl]methyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

482.303224444 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

19-[(E)-3-(3-Methoxy-4-hydroxyphenyl)propenoyloxy]labda-13(16),14-diene-8-ol

1 reference

based on heuristic

inferred from InChIKey

[(1S,4aS,5R,6R,8aR)-6-hydroxy-1,4a,6-trimethyl-5-(3-methylidenepent-4-enyl)-3,4,5,7,8,8a-hexahydro-2H-naphthalen-1-yl]methyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₃₀H₄₂O₅

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canonical SMILES

O=C(OCC1(C)CCCC2(C)C(CCC(=C)C=C)C(O)(C)CCC12)C=CC3=CC=C(O)C(OC)=C3

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isomeric SMILES

C=CC(=C)CC[C@@H]1[C@@]2(C)CCC[C@](C)(COC(=O)/C=C\c3ccc(O)c(OC)c3)[C@@H]2CC[C@@]1(C)O

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found in taxon

Chamaecyparis formosensis

1 reference

stated in

Terpenes and lignans from leaves of Chamaecyparis formosensis

Fokienia hodginsii

1 reference

stated in

Diterpenoids from the twigs and leaves of Fokienia hodginsii

Identifiers

InChI

InChI=1S/C30H42O5/c1-7-21(2)9-13-26-29(4)17-8-16-28(3,25(29)15-18-30(26,5)33)20-35-27(32)14-11-22-10-12-23(31)24(19-22)34-6/h7,10-12,14,19,25-26,31,33H,1-2,8-9,13,15-18,20H2,3-6H3/b14-11-/t25-,26+,28+,29-,30+/m0/s1

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InChIKey

WTJDZDHSLHRPOC-LODGTALCSA-N

0 references

2 references

26 December 2021

matched by identifier from

InChIKey

WTJDZDHSLHRPOC-LODGTALCSA-N

1 reference

(Q105312587)

[(1S,4aS,5R,6R,8aR)-6-hydroxy-1,4a,6-trimethyl-5-(3-methylidenepent-4-enyl)-3,4,5,7,8,8a-hexahydro-2H-naphthalen-1-yl]methyl (Z)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

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