(Q105298516)

English

(1S,3R,10R,13S,14S,17R,18R)-14,18-dimethyl-17-[(2R)-6-methylhept-5-en-2-yl]-9-methylidene-7-oxapentacyclo[11.7.0.01,3.03,10.014,18]icosan-6-one

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

14,18-Dimethyl-17-(6-methylhept-5-en-2-yl)-9-methylidene-7-oxapentacyclo[11.7.0.01,3.03,10.014,18]icosan-6-one

1 reference

based on heuristic

inferred from SMILES

mass

438.349780712 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₀H₄₆O₂

0 references

canonical SMILES

O=C1OCC(=C)C2CCC3C4(C)CCC(C(C)CCC=C(C)C)C4(C)CCC53CC25CC1

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isomeric SMILES

C=C1COC(=O)CC[C@]23C[C@]24CC[C@]2(C)[C@@H]([C@H](C)CCC=C(C)C)CC[C@@]2(C)[C@@H]4CC[C@@H]13

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found in taxon

Gardenia tubifera

1 reference

stated in

Cytotoxic and anti-HIV-1 constituents from leaves and twigs of Gardenia tubifera

Identifiers

InChI

InChI=1S/C30H46O2/c1-20(2)8-7-9-21(3)23-12-14-28(6)25-11-10-24-22(4)18-32-26(31)13-15-29(24)19-30(25,29)17-16-27(23,28)5/h8,21,23-25H,4,7,9-19H2,1-3,5-6H3/t21-,23-,24+,25+,27-,28+,29-,30+/m1/s1

0 references

InChIKey

VXHZFEOUKLCDJD-RISGNIHZSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VXHZFEOUKLCDJD-RISGNIHZSA-N

1 reference

(Q105298516)

(1S,3R,10R,13S,14S,17R,18R)-14,18-dimethyl-17-[(2R)-6-methylhept-5-en-2-yl]-9-methylidene-7-oxapentacyclo[11.7.0.01,3.03,10.014,18]icosan-6-one

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Identifiers

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