Concept information
Preferred term
نئوسارتورین
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C34H32O15
inchi
- InChI=1S/C34H32O15/c1-12-11-19-23(28(42)24-17(37)8-9-20(39)33(24,48-19)31(43)45-4)26(40)21(12)15-6-7-16(36)22-27(41)25-18(38)10-13(2)30(47-14(3)35)34(25,32(44)46-5)49-29(15)22/h6-7,11,13,20,30,36,39-42H,8-10H2,1-5H3/t13-,20-,30-,33-,34+/m0/s1
inchikey
- UZQYGWABJZFBJP-NCMNGAEISA-N
mass
- 680.615
monoisotopicmass
- 680.17412
smiles
- O=C1C2=C(O)C3=C(C(C4=C(O)C=5C(O)=C6C(=O)CC[C@@H]([C@]6(C(=O)OC)OC5C=C4C)O)=CC=C3O)O[C@@]2(C(=O)OC)[C@@H](OC(=O)C)[C@H](C1)C
subset
- 2_STAR
synonym EXACT
- methyl (4S,4aR)-7-[(5S,6S,10aR)-5-acetyloxy-1,9-dihydroxy-10a-methoxycarbonyl-6-methyl-8-oxo-6,7-dihydro-5H-xanthen-4-yl]-4,8,9-trihydroxy-6-methyl-1-oxo-3,4-dihydro-2H-xanthene-4a-carboxylate
In other languages
-
English
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:215991
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