(Q105284975)

English

8H,11H-Cyclopenta[5,6]cyclopropa[1,8a]naphtho[2,1-c]oxepin-8-one, 1-[(1R)-1,5-dimethyl-4-hexenyl]tetradecahydro-3a,13a-dimethyl-6-methylene-, (1R,3aS,3bS,5aR,10aR,11aS,13aR)-

chemical compound

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instance of

type of chemical entity

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subclass of

chemical compound

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mass

424.334130648 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₉H₄₄O₂

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canonical SMILES

O=C1OC(=C)C2CCC3C4(C)CCC(C(C)CCC=C(C)C)C4(C)CCC53CC25CC1

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isomeric SMILES

C=C1OC(=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

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stated in

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

Identifiers

InChI

InChI=1S/C29H44O2/c1-19(2)8-7-9-20(3)22-12-14-27(6)24-11-10-23-21(4)31-25(30)13-15-28(23)18-29(24,28)17-16-26(22,27)5/h8,20,22-24H,4,7,9-18H2,1-3,5-6H3/t20-,22-,23+,24+,26-,27+,28-,29+/m1/s1

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InChIKey

VFAMPHJYZBUSOU-YAYWIXMOSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

VFAMPHJYZBUSOU-YAYWIXMOSA-N

1 reference

(Q105284975)

8H,11H-Cyclopenta[5,6]cyclopropa[1,8a]naphtho[2,1-c]oxepin-8-one, 1-[(1R)-1,5-dimethyl-4-hexenyl]tetradecahydro-3a,13a-dimethyl-6-methylene-, (1R,3aS,3bS,5aR,10aR,11aS,13aR)-

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Identifiers

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