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CHEBI:756184 - ramoplanin a2 (main component)

Default Structure
ChEBI IDCHEBI:756184
ChEBI Nameramoplanin a2 (main component)
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC119H154ClN21O40
Net Charge0
Average Mass2554.101
Monoisotopic Mass2552.03505
SMILES[H][C@]1([C@@H](C)O)NC(=O)[C@H](c2ccc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O[C@@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]3O)cc2)NC(=O)[C@@H](CCCN)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@]([H])([C@H](C)O)NC(=O)[C@@H](c2ccc(O)cc2)NC(=O)[C@H](c2ccc(O)cc2)NC(=O)[C@@]([H])([C@@H](C)O)NC(=O)[C@@H](CCCN)NC(=O)[C@@H](c2ccc(O)cc2)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)/C=C/C=C/CC(C)C)[C@@H](C(N)=O)OC(=O)[C@H](c2ccc(O)c(Cl)c2)NC(=O)[C@@H](C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](c2ccc(O)cc2)NC1=O
InChIInChI=1S/C119H154ClN21O40/c1-54(2)17-11-9-14-22-82(153)127-77(50-81(123)152)107(166)141-93-99(101(124)160)180-117(176)92(66-33-44-78(151)72(120)49-66)140-102(161)56(5)126-105(164)75(47-55(3)4)128-83(154)51-125-108(167)87(61-23-34-67(147)35-24-61)136-111(170)86(59(8)146)134-113(172)89(65-31-42-71(43-32-65)177-119-100(97(158)95(156)80(53-143)179-119)181-118-98(159)96(157)94(155)79(52-142)178-118)135-104(163)73(20-15-45-121)129-106(165)76(48-60-18-12-10-13-19-60)131-109(168)84(57(6)144)133-114(173)90(63-27-38-69(149)39-28-63)138-115(174)91(64-29-40-70(150)41-30-64)137-110(169)85(58(7)145)132-103(162)74(21-16-46-122)130-112(171)88(139-116(93)175)62-25-36-68(148)37-26-62/h9-14,18-19,22-44,49,54-59,73-77,79-80,84-100,118-119,142-151,155-159H,15-17,20-21,45-48,50-53,121-122H2,1-8H3,(H2,123,152)(H2,124,160)(H,125,167)(H,126,164)(H,127,153)(H,128,154)(H,129,165)(H,130,171)(H,131,168)(H,132,162)(H,133,173)(H,134,172)(H,135,163)(H,136,170)(H,137,169)(H,138,174)(H,139,175)(H,140,161)(H,141,166)/b11-9+,22-14+/t56-,57+,58-,59-,73-,74-,75+,76+,77+,79+,80-,84+,85-,86-,87+,88-,89+,90-,91+,92+,93+,94+,95-,96-,97+,98-,99+,100+,118+,119+/m1/s1
InChIKeyKGZHFKDNSAEOJX-RYAIWOGKSA-N
ChEBI Ontology
Outgoing Relation(s)
ramoplanin a2 (main component) (CHEBI:756184) is a lactam (CHEBI:24995)
ramoplanin a2 (main component) (CHEBI:756184) is a macrolide (CHEBI:25106)
Synonym  Source
Ramoplanin a2 (main component) component of ramoplanin a2 (main )ChEMBL