BUFOTOXIN ,464-81-3 _Chemical Cloud Database

BUFOTOXIN

Basic Information
Product Name：	BUFOTOXIN
CAS：	464-81-3
English Synonyms：	BUFOTOXIN
MDL Number.：	MFCD01740825
H bond acceptor：	14
H bond donor：	6
Smile：	CC(=O)O[C@H]1C[C@@]2([C@@H]3CC[C@@H]4C[C@H](CC[C@@]4([C@H]3CC[C@@]2([C@H]1c5ccc(=O)oc5)C)C)OC(=O)[C@H](CCCNC(=N)N)NC(=O)CCCCCCC(=O)O)O
InChi：	InChI=1S/C40H60N4O10/c1-24(45)53-31-22-40(51)29-14-13-26-21-27(16-18-38(26,2)28(29)17-19-39(40,3)35(31)25-12-15-34(49)52-23-25)54-36(50)30(9-8-20-43-37(41)42)44-32(46)10-6-4-5-7-11-33(47)48/h12,15,23,26-31,35,51H,4-11,13-14,16-22H2,1-3H3,(H,44,46)(H,47,48)(H4,41,42,43)/t26-,27+,28+,29-,30+,31+,35+,38+,39-,40+/m1/s1
InChiKey：	InChIKey=DKAWEPORCGVQCP-JBXNKDOXSA-N

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