longikaurin C (Q27138712)

(5beta,6beta,7alpha,8alpha,9beta,10alpha)-6,7-Dihydroxy-15-oxo-7,20-epoxykaur-16-en-18-yl acetate (English)

7 October 2016

chemical formula

C₂₂H₃₀O₆

0 references

canonical SMILES

C=C1C2(CCC3(C45CCCC(C)(COC(C)=O)C5(C(C(C3(C2)C1=O)(O)OC4)(O)[H])[H])[H])[H]

1 reference

longikaurin C (English)

7 October 2016

isomeric SMILES

C=C1C2(CC[C@]3([C@@]45CCC[C@@](C)(COC(C)=O)[C@]5([C@@]([C@]([C@]3(C2)C1=O)(O)OC4)(O)[H])[H])[H])[H]

1 reference

Bioactive ent-kaurane diterpenoids from Isodon rubescens.

longikaurin C (English)

7 October 2016

1 reference

Identifiers

InChI

InChI=1S/C22H30O6/c1-12-14-5-6-15-20-8-4-7-19(3,10-27-13(2)23)16(20)18(25)22(26,28-11-20)21(15,9-14)17(12)24/h14-16,18,25-26H,1,4-11H2,2-3H3/t14?,15-,16+,18-,19-,20+,21-,22-/m0/s1

1 reference

longikaurin C (English)

HSMCZGYOVWATPU-FSKRNUERSA-N

7 October 2016

InChIKey

2 references

longikaurin C (English)

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

matched by identifier from

(5beta,6beta,7alpha,8alpha,9beta,10alpha)-6,7-Dihydroxy-15-oxo-7,20-epoxykaur-16-en-18-yl acetate (English)

7 October 2016

2 references

26 December 2021

InChIKey

HSMCZGYOVWATPU-FSKRNUERSA-N

ChEBI ID

70372

mapping relation type

2 references

longikaurin C (English)