2-[2-[(3aS,5R,6R,6aS)-6-[(E,3S)-3-cyclopentyl-3-oxidanyl-prop-1-enyl]-5-oxidanyl-1,3a,4,5,6,6a-hexahydropentalen-2-yl]prop-2-enoxy]ethanoic acid

Systemtic Name: 2-[2-[(3aS,5R,6R,6aS)-6-[(E,3S)-3-cyclopentyl-3-oxidanyl-prop-1-enyl]-5-oxidanyl-1,3a,4,5,6,6a-hexahydropentalen-2-yl]prop-2-enoxy]ethanoic acid Openeye Name: 2-[2-[(3aS,5R,6R,6aS)-6-[(E,3S)-3-cyclopentyl-3-hydroxy-prop-1-enyl]-5-hydroxy-1,3a,4,5,6,6a-hexahydropentalen-2-yl]allyloxy]acetic acid CAS Name: 2-[2-[(3aS,5R,6R,6aS)-6-[(E,3S)-3-cyclopentyl-3-hydroxyprop-1-enyl]-5-hydroxy-1,3a,4,5,6,6a-hexahydropentalen-2-yl]prop-2-enoxy]acetic acid IUPAC Name: 2-[2-[(3aS,5R,6R,6aS)-6-[(E,3S)-3-cyclopentyl-3-hydroxyprop-1-enyl]-5-hydroxy-1,3a,4,5,6,6a-hexahydropentalen-2-yl]prop-2-enoxy]acetic acid Traditional Name: 2-[2-[(3aS,5R,6R,6aS)-6-[(E,3S)-3-cyclopentyl-3-hydroxy-prop-1-enyl]-5-hydroxy-1,3a,4,5,6,6a-hexahydropentalen-2-yl]allyloxy]acetic acid Formula: C21H30O5 MolecularWeight: 362.4599

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Descriptors Computed from Structure

Canonical SMILES:

C=C(COCC(=O)O)C1=CC2CC(C(C2C1)C=CC(C3CCCC3)O)O

Isomeric SMILES

C=C(COCC(=O)O)C1=C[C@H]2C[C@H]([C@@H]([C@H]2C1)/C=C/[C@H](C3CCCC3)O)O

InChI

InChI=1S/C21H30O5/c1-13(11-26-12-21(24)25)15-8-16-10-20(23)17(18(16)9-15)6-7-19(22)14-4-2-3-5-14/h6-8,14,16-20,22-23H,1-5,9-12H2,(H,24,25)/b7-6+/t16-,17+,18-,19+,20+/m0/s1