BREDEMOLIC ACID ,5957-40-4 _Chemical Cloud Database

BREDEMOLIC ACID

Basic Information
Product Name：	BREDEMOLIC ACID
CAS：	5957-40-4
English Synonyms：	BREDEMOLIC ACID ; (2BETA,3A)-2,3-DIHYDROXY-OLEAN-12-EN-28-OIC ACID
MDL Number.：	MFCD09954364
H bond acceptor：	4
H bond donor：	3
Smile：	CC1(CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(C[C@@H]([C@H](C5(C)C)O)O)C)C)[C@@H]2C1)C)C(=O)O)C
InChi：	InChI=1S/C30H48O4/c1-25(2)12-14-30(24(33)34)15-13-28(6)18(19(30)16-25)8-9-22-27(5)17-20(31)23(32)26(3,4)21(27)10-11-29(22,28)7/h8,19-23,31-32H,9-17H2,1-7H3,(H,33,34)/t19-,20-,21-,22+,23+,27-,28+,29+,30-/m0/s1
InChiKey：	InChIKey=MDZKJHQSJHYOHJ-SXISEVPCSA-N

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