(Q105157536)

English

[(1R,2S,4S,5S,9R,10S,13R,14S)-2-hydroxy-5,9,14-trimethyl-15-oxo-5-tetracyclo[11.2.1.01,10.04,9]hexadecanyl]methyl acetate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

(2-Hydroxy-5,9,14-trimethyl-15-oxo-5-tetracyclo[11.2.1.01,10.04,9]hexadecanyl)methyl acetate

1 reference

based on heuristic

inferred from SMILES

mass

362.245709568 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

19-Acetoxy-7alpha-hydroxykaurane-15-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₂H₃₄O₄

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canonical SMILES

O=C(OCC1(C)CCCC2(C)C3CCC4CC3(C(=O)C4C)C(O)CC12)C

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isomeric SMILES

CC(=O)OC[C@@]1(C)CCC[C@]2(C)[C@@H]1C[C@H](O)[C@@]13C[C@@H](CC[C@@H]21)[C@H](C)C3=O

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found in taxon

Croton kongensis

2 references

stated in

Crotonkinins A and B and related diterpenoids from Croton tonkinensis as anti-inflammatory and antitumor agents

stated in

Anti-inflammatory diterpenoids from Croton tonkinensis

Identifiers

InChI

InChI=1S/C22H34O4/c1-13-15-6-7-16-21(4)9-5-8-20(3,12-26-14(2)23)17(21)10-18(24)22(16,11-15)19(13)25/h13,15-18,24H,5-12H2,1-4H3/t13-,15+,16-,17+,18-,20+,21-,22+/m0/s1

0 references

InChIKey

LULOWBNDQZZTNH-VXPSWAMVSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

LULOWBNDQZZTNH-VXPSWAMVSA-N

1 reference

(Q105157536)

[(1R,2S,4S,5S,9R,10S,13R,14S)-2-hydroxy-5,9,14-trimethyl-15-oxo-5-tetracyclo[11.2.1.01,10.04,9]hexadecanyl]methyl acetate

Statements

Identifiers

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