(Q27138715)

CHEBI:70375 (English)

(1S,2S,5S,8S,9R,11R,15S,16R,18R)-15,18-dihydroxy-16-methoxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one

7 October 2016

stereoisomer of

1 reference

based on heuristic

inferred from InChI

(1S,2S,5S,8S,9R,11R,15S,16S,18R)-15,18-dihydroxy-16-methoxy-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 InChI

chemical formula

C₂₁H₃₀O₅

1 reference

CHEBI:70375 (English)

7 October 2016

canonical SMILES

CC1(CCC(C23C1CC(C45C2CCC(C4O)C(=C)C5=O)OC3OC)O)C

1 reference

CHEBI:70375 (English)

7 October 2016

isomeric SMILES

CC1(CC[C@@H]([C@]23[C@@H]1C[C@H]([C@]45[C@H]2CC[C@@H]([C@H]4O)C(=C)C5=O)O[C@@H]3OC)O)C

1 reference

Four new ent-kauranoids from Isodon rubescens var. lushanensis and data reassignment of dayecrystal B.

CHEBI:70375 (English)

7 October 2016

1 reference

Isodon excisus

1 reference

A diterpenoid fromRabdosia excisa

Isodon henryi

1 reference

Structure and Bonding

Isodon umbrosus

1 reference

Structural elucidation of new diterpenoids isolated from Rabdosia umbrosa var. leucantha f. Kameba

Identifiers

InChI

InChI=1S/C21H30O5/c1-10-11-5-6-12-20-13(19(2,3)8-7-14(20)22)9-15(26-18(20)25-4)21(12,16(10)23)17(11)24/h11-15,17-18,22,24H,1,5-9H2,2-4H3/t11-,12+,13-,14+,15-,17-,18+,20-,21+/m1/s1

1 reference

CHEBI:70375 (English)

HZXIWBLGRBHNQF-ZVXCJKLWSA-N

7 October 2016

InChIKey

2 references

CHEBI:70375 (English)

7 October 2016

ChEBI release 2020-09-01

1 reference

(1alpha,5beta,7alpha,8alpha,9beta,10alpha,14R,20S)-1,14-Dihydroxy-20-methoxy-7,20-epoxykaur-16-en-15-one (English)

7 October 2016

2 references

CHEBI:70375 (English)

matched by identifier from

7 October 2016

InChIKey

HZXIWBLGRBHNQF-ZVXCJKLWSA-N

ChEBI ID

70375

mapping relation type

2 references

kamebacetal A (English)