(Q27136146)

CHEBI:67674 (English)

[(1S,2S,3R,5S,6S,8S,9S,10S,11R)-9,10-dihydroxy-6-(methoxymethyl)-12,12-dimethyl-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-3-yl] acetate

7 October 2016

stereoisomer of

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₃H₃₄O₇

1 reference

CHEBI:67674 (English)

7 October 2016

canonical SMILES

CC(=O)OC1CC2CC3(C1C45CCCC(C4C(C3(OC5)O)O)(C)C)C(=O)C2COC

1 reference

CHEBI:67674 (English)

7 October 2016

isomeric SMILES

CC(=O)O[C@@H]1C[C@H]2C[C@]3([C@@H]1[C@]45CCCC([C@H]4[C@@H]([C@]3(OC5)O)O)(C)C)C(=O)[C@@H]2COC

1 reference

Diterpenoids from rabdosia lihsienensis

CHEBI:67674 (English)

7 October 2016

2 references

stated in

Diterpenoids from rabdosia lihsienensis

Isodon adenolomus

1 reference

stated in

Diterpenoids from Isodon adenoloma

Identifiers

InChI

InChI=1S/C23H34O7/c1-12(24)30-15-8-13-9-22(18(25)14(13)10-28-4)16(15)21-7-5-6-20(2,3)17(21)19(26)23(22,27)29-11-21/h13-17,19,26-27H,5-11H2,1-4H3/t13-,14+,15+,16-,17+,19-,21+,22-,23+/m0/s1

1 reference

CHEBI:67674 (English)

VVSBOWDVUWUVCK-ZTDGPNIRSA-N

7 October 2016

InChIKey

2 references

CHEBI:67674 (English)

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(5beta,6beta,7alpha,8alpha,9beta,10alpha,11alpha,16beta)-6,7-Dihydroxy-17-methoxy-15-oxo-7,20-epoxykauran-11-yl acetate (English)

7 October 2016

2 references

CHEBI:67674 (English)

matched by identifier from

7 October 2016

InChIKey

VVSBOWDVUWUVCK-ZTDGPNIRSA-N

ChEBI ID

67674

mapping relation type

2 references

Adenolin D (English)