Crystallography Open Database

Information card for entry 2000358

2000357 << 2000358 >> 2000359

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Coordinates	2000358.cif
Original IUCr paper	HTML

Structure parameters

Formula	C22 H32 O5
Calculated formula	C22 H32 O5
SMILES	CC(=O)O[C@@H]1O[C@@H]2[C@H]([C@H]1CC(=O)O2)C(=C)[C@H]1CC[C@@H]2[C@]1(C)CCCC2(C)C
Title of publication	Structure of chelonaplysin C: a spongian diterpenoid from nudibranch <i>Chromodoris luteorosea</i>
Authors of publication	Puliti, R.; Gavagnin, M.; Cimino, G.; Mattia, C. A.; Mazzarella, L.
Journal of publication	Acta Crystallographica Section C
Year of publication	1992
Journal volume	48
Journal issue	12
Pages of publication	2145 - 2147
a	8.3737 ± 0.0008 Å
b	10.6469 ± 0.0008 Å
c	22.429 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	1999.6 ± 0.3 Å³
Number of distinct elements	3
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	Cu
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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