(Q104056526)

English

(4aR,5S,6R,8aR)-5-[(Z)-4-carboxy-3-methylbut-3-enyl]-5,6,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylic acid

chemical compound

glutinic acid diterpene

In more languages

Statements

type of chemical entity

0 references

clerodane diterpenoid

1 reference

based on heuristic

inferred from SMILES

334.21440944 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

Haplopappic acid

1 reference

based on heuristic

inferred from InChI

(4aS,5S,6R,8aR)-5-[(E)-4-carboxy-3-methylbut-3-enyl]-5,6,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylic acid

1 reference

based on heuristic

inferred from InChI

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₃₀O₄

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canonical SMILES

CC(=CC(=O)O)CCC1(C)C(C)CCC2(C)C(C(=O)O)=CCCC21

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

C/C(=C/C(=O)O)CC[C@@]1(C)[C@H](C)CC[C@@]2(C)C(C(=O)O)=CCC[C@H]12

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI=1S/C20H30O4/c1-13(12-17(21)22)8-10-19(3)14(2)9-11-20(4)15(18(23)24)6-5-7-16(19)20/h6,12,14,16H,5,7-11H2,1-4H3,(H,21,22)(H,23,24)/b13-12-/t14-,16-,19+,20+/m1/s1

0 references

FMWSHZRIJXQMOO-RUJIAIRVSA-N

1 reference

based on heuristic

inferred from InChI

CAS Registry Number

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1 reference

matched by identifier from

FMWSHZRIJXQMOO-RUJIAIRVSA-N

UniChem compound ID

1 reference

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