(Q27132710)

9beta-pimara-7,15-dien-19-oate (English)

7 October 2016

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₉O₂⁻

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CC1(CCC2C(=CCC3C2(CCCC3(C)C(=O)[O-])C)C1)C=C

1 reference

9beta-pimara-7,15-dien-19-oate (English)

7 October 2016

isomeric SMILES

C[C@]1(CC[C@@H]2C(=CC[C@@H]3[C@@]2(CCC[C@]3(C)C(=O)[O-])C)C1)C=C

1 reference

9beta-pimara-7,15-dien-19-oate (English)

InChI=1S/C20H30O2/c1-5-18(2)12-9-15-14(13-18)7-8-16-19(15,3)10-6-11-20(16,4)17(21)22/h5,7,15-16H,1,6,8-13H2,2-4H3,(H,21,22)/p-1/t15-,16-,18-,19-,20+/m1/s1

7 October 2016

Identifiers

InChI

1 reference

9beta-pimara-7,15-dien-19-oate (English)

MXYATHGRPJZBNA-BDUQCRIQSA-M

7 October 2016

InChIKey

2 references

9beta-pimara-7,15-dien-19-oate (English)

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

9beta-pimara-7,15-dien-19-oate (English)

7 October 2016

1 reference

9beta-pimara-7,15-dien-19-oate (English)

7 October 2016

ChEBI ID

63659

mapping relation type

1 reference