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Didemnin B

PropertiesImageOccurences in reactions
MNX_IDMNXM104534Image of MNXM104534
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC57H89N7O15
charge0
mass1111.64167
referencechebi:68856
InChIKeyKYHUYMLIVQFXRI-SJPGYWQQSA-N
InChIInChI=1S/C57H89N7O15/c1-15-33(8)46-44(66)29-45(67)79-49(32(6)7)48(68)34(9)50(69)58-39(26-30(2)3)54(73)64-25-17-19-41(64)56(75)62(13)43(28-37-20-22-38(77-14)23-21-37)57(76)78-36(11)47(52(71)59-46)60-51(70)42(27-31(4)5)61(12)55(74)40-18-16-24-63(40)53(72)35(10)65/h20-23,30-36,39-44,46-47,49,65-66H,15-19,24-29H2,1-14H3,(H,58,69)(H,59,71)(H,60,70)/t33-,34-,35-,36+,39-,40-,41-,42+,43-,44-,46+,47-,49-/m0/s1
SMILESCC[C@H](C)[C@H]1NC(=O)[C@@H](NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@@H]2CCCN2C(=O)[C@H](C)O)[C@@H](C)OC(=O)[C@H](Cc2ccc(OC)cc2)N(C)C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)C(=O)[C@H](C(C)C)OC(=O)C[C@@H]1O
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 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:68856
chebi:68856 		Didemnin B
Didemnin A, N-(1-(2-hydroxy-1-oxopropyl)-L-prolyl)-, (S)-
seed.compound:cpd17157
seedM:cpd17157
kegg.compound:C16847
keggC:C16847 		Didemnin B
keggC:M_C16847
seedM:M_cpd17157 		secondary/obsolete/fantasy identifier