CONVALLAMARIN ,1391-12-4 _Chemical Cloud Database

CONVALLAMARIN

Basic Information
Product Name：	CONVALLAMARIN
CAS：	1391-12-4
English Synonyms：	CONVALLAMARIN
MDL Number.：	MFCD00046957
H bond acceptor：	4
H bond donor：	2
Smile：	C[C@H]1[C@H]2[C@H](C[C@@H]3[C@@]2(CC[C@H]4[C@H]3CC[C@H]5[C@@]4([C@@H](C[C@@H](C5)O)O)C)C)O[C@]16CCC(=C)CO6
InChi：	InChI=1S/C27H42O4/c1-15-7-10-27(30-14-15)16(2)24-22(31-27)13-21-19-6-5-17-11-18(28)12-23(29)26(17,4)20(19)8-9-25(21,24)3/h16-24,28-29H,1,5-14H2,2-4H3/t16-,17+,18+,19+,20-,21-,22-,23+,24-,25-,26-,27+/m0/s1
InChiKey：	InChIKey=XLHFBXMTUNORSV-ZENYHQJXSA-N

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