GHS
GHS Classification Search
2,2-Dimethyl-3alpha,4abeta-dichloro-6-hydroxy-12abeta,8-[(2E,6E)-3-methyl-2-hexene-1-yl-6-ylidene]-3,4,4a,8,9,12a-hexahydro-2H,7H-1,10-dioxanaphthacene-5,12-dione
CAS Number: 1013027-31-0
IUPAC name: (1S,4R,6R,14Z,18Z)-4,6-dichloro-9-hydroxy-3,3,18-trimethyl-2,12-dioxapentacyclo[9.9.3.110,14.01,6.08,22]tetracosa-8,10,14,18,22-pentaene-7,21-dione
Molecular formula: C25H26Cl2O5
Molecular weight: 477.4
InChI: InChI=1S/C25H26Cl2O5/c1-13-5-4-6-14-9-15-17(31-12-14)10-16-19(20(15)28)22(30)24(27)11-18(26)23(2,3)32-25(24,8-7-13)21(16)29/h6-7,10,18,28H,4-5,8-9,11-12H2,1-3H3/b13-7-,14-6-/t18-,24+,25+/m1/s1
InChIKey: CGYXUANFCZTNCN-YWURJBTNSA-N
SMILES: C/C/1=C/C[C@]23C(=O)C4=CC5=C(C/C(=C/CC1)/CO5)C(=C4C(=O)[C@]2(C[C@H](C(O3)(C)C)Cl)Cl)O
EINECS: -
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