(Q104402898)

English

(1R,2S,5S,8R,9S,10S,11R,18R)-9,10,18-trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one

chemical compound

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instance of

type of chemical entity

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subclass of

(2S,9R,10S,11R)-9,10,18-trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-one

1 reference

based on heuristic

inferred from SMILES

6,7,14-Trihydroxy-7,20-epoxykaur-16-en-15-one

1 reference

based on heuristic

inferred from SMILES

mass

348.193673996 dalton

1 reference

1 reference

C₂₀H₂₈O₅

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canonical SMILES

O=C1C(=C)C2CCC3C45COC(O)(C(O)C5C(C)(C)CCC4)C13C2O

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isomeric SMILES

C=C1C(=O)[C@@]23[C@@H](CC[C@@H]1[C@H]2O)[C@]12CCCC(C)(C)[C@H]1[C@H](O)[C@@]3(O)OC2

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found in taxon

Isodon trichocarpus

1 reference

stated in

An investigation of diterpenes from the leaves of Rabdosia trichocarpa and their antibacterial activity against oral microorganisms

Isodon longitubus

3 references

stated in

Structure elucidation of longikaurin A and longikaurin B, new biologically active diterpenoids from Rabdosia longituba and chemical conversion of oridonin into dihydrolongikaurin A

stated in

Longikaurin A and B; new, biologically active diterpenoids from Rabdosia longituba

stated in

Structure elucidation of longikaurin A and longikaurin B, new biologically active diterpenoids from Rabdosia longituba and chemical conversion of oridonin into dihydrolongikaurin A

Isodon adenolomus

1 reference

stated in

Structure and cytotoxicity of diterpenoids from Isodon adenolomus

Isodon phyllostachys

1 reference

stated in

ent‐Kaurane Diterpenoids fromIsodon phyllostachys

Identifiers

InChI

InChI=1S/C20H28O5/c1-10-11-5-6-12-18-8-4-7-17(2,3)13(18)16(23)20(24,25-9-18)19(12,14(10)21)15(11)22/h11-13,15-16,22-24H,1,4-9H2,2-3H3/t11-,12-,13+,15+,16-,18+,19-,20+/m0/s1

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InChIKey

PSVHVXLCVSKJGM-MHRDNBEJSA-N

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CAS Registry Number

75207-67-9

1 reference

stated in

CAS (formerly Chemical Abstracts Service)

25 January 2022

1 reference

17 September 2022

inferred from InChIKey

1 reference

(Q104402898)

(1R,2S,5S,8R,9S,10S,11R,18R)-9,10,18-trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one

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Identifiers

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