(Q104967289)

English

(1S,4R,9R,10S,13R,16R)-16-hydroxy-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecan-15-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

kaurane diterpenoid

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mass

302.2245802 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₃₀O₂

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canonical SMILES

O=C1C(=C)C2CCC3C1(CCC4C(C)(C)CCCC43C)C2O

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isomeric SMILES

C=C1C(=O)[C@@]23CC[C@@H]4C(C)(C)CCC[C@@]4(C)[C@@H]2CC[C@H]1[C@H]3O

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found in taxon

Croton kongensis

1 reference

stated in

Anti-inflammatory diterpenoids from Croton tonkinensis

Identifiers

InChI

InChI=1S/C20H30O2/c1-12-13-6-7-15-19(4)10-5-9-18(2,3)14(19)8-11-20(15,16(12)21)17(13)22/h13-15,17,22H,1,5-11H2,2-4H3/t13-,14-,15+,17-,19-,20-/m1/s1

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InChIKey

COTLKOPMPRAKRJ-NGZXWKFYSA-N

0 references

2 references

26 December 2021

matched by identifier from

InChIKey

COTLKOPMPRAKRJ-NGZXWKFYSA-N

1 reference

(Q104967289)

(1S,4R,9R,10S,13R,16R)-16-hydroxy-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecan-15-one

Statements

Identifiers

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